#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvv s ILE 36 N 0.00 3.59 0.13 3.84 1.01 -1.26 -4.98 121.20 123.53 2wvv s ILE 36 Ca 0.00 0.96 -0.31 0.00 0.00 0.00 0.00 60.65 61.30 2wvv s ILE 36 Cb 0.00 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.75 2wvv s ILE 36 CO 0.00 -0.01 1.66 -2.84 0.00 0.00 0.00 174.94 173.75 2wvv s PRO 37 N 2.59 4.19 -0.00 2.79 0.02 -1.26 -4.85 135.00 138.48 2wvv s PRO 37 Ca 0.66 2.42 -0.00 0.00 0.02 0.00 0.00 61.00 64.10 2wvv s PRO 37 Cb -0.33 -3.37 -0.00 0.00 0.02 0.00 0.00 34.50 30.82 2wvv s PRO 37 CO 0.27 -0.70 0.00 -0.51 -0.33 0.00 0.00 177.00 175.73 2wvv s LEU 38 N 1.91 1.99 -0.04 -5.54 1.43 -1.26 -5.03 118.68 112.15 2wvv s LEU 38 Ca 0.74 -0.01 0.19 0.00 -1.03 0.00 0.00 54.13 54.02 2wvv s LEU 38 Cb -0.43 0.02 -0.23 0.00 0.03 0.00 0.00 46.19 45.57 2wvv s LEU 38 CO 0.32 -0.01 0.50 0.29 0.23 0.00 0.00 176.35 177.68 2wvv n LYS 39 N 3.02 0.65 -0.33 1.70 5.02 -1.26 -4.60 118.16 122.36 2wvv n LYS 39 Ca -0.12 -0.01 0.08 0.00 -2.02 0.00 0.00 58.31 56.24 2wvv n LYS 39 Cb 0.60 -1.62 0.14 0.00 -0.02 0.00 0.00 35.03 34.13 2wvv n LYS 39 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2wvv n TYR 40 N -2.60 0.00 -0.26 2.13 4.01 -1.26 -5.01 117.16 114.17 2wvv n TYR 40 Ca -0.14 -1.04 0.00 0.00 -0.16 0.00 0.00 57.90 56.57 2wvv n TYR 40 Cb 0.81 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 2wvv n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvv n GLY 41 N -1.13 0.45 3.76 2.72 0.00 -1.26 -4.30 105.19 105.43 2wvv n GLY 41 Ca 0.15 -1.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 2wvv n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wvv s ALA 42 N -3.74 3.10 -0.15 4.61 0.00 -1.26 -4.96 121.76 119.35 2wvv s ALA 42 Ca 0.00 1.29 0.04 0.00 0.00 0.00 0.00 51.96 53.29 2wvv s ALA 42 Cb 0.00 -3.52 -0.12 0.00 0.00 0.00 0.00 23.12 19.47 2wvv s ALA 42 CO 0.00 -1.06 -0.08 0.25 0.00 0.00 0.00 175.76 174.87 2wvv n THR 43 N -0.36 0.91 -2.97 0.00 -2.24 -1.26 -4.99 114.28 103.36 2wvv n THR 43 Ca 0.06 -0.41 -0.40 0.00 -2.27 0.00 0.00 64.05 61.04 2wvv n THR 43 Cb 0.44 -0.94 -0.06 0.00 -2.10 0.00 0.00 70.33 67.67 2wvv n THR 43 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wvv s ASN 44 N -5.24 7.38 0.00 3.42 0.01 -1.26 -5.03 114.94 114.21 2wvv s ASN 44 Ca -0.17 1.63 0.00 0.00 -0.71 0.00 0.00 52.86 53.61 2wvv s ASN 44 Cb 0.05 -2.50 0.00 0.00 0.41 0.00 0.00 41.25 39.21 2wvv s ASN 44 CO 0.42 0.18 0.00 -0.62 -1.51 0.00 0.00 177.10 175.56 2wvv n GLU 45 N 1.78 0.00 0.00 -0.60 -0.58 -1.26 -4.92 120.64 115.07 2wvv n GLU 45 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2wvv n GLU 45 Cb 0.49 -0.30 0.00 0.00 -0.57 0.00 0.00 31.44 31.06 2wvv n GLU 45 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wvv n GLY 46 N 2.64 1.07 3.76 0.62 0.00 -1.26 -5.01 105.19 107.02 2wvv n GLY 46 Ca 0.00 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 2wvv n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvv s LYS 47 N 2.04 4.24 0.28 1.61 1.02 -1.26 -4.99 119.74 122.68 2wvv s LYS 47 Ca 0.00 2.37 -0.30 0.00 0.02 0.00 0.00 55.97 58.06 2wvv s LYS 47 Cb 0.00 -3.05 -0.12 0.00 -0.52 0.00 0.00 37.83 34.14 2wvv s LYS 47 CO 0.00 -0.40 1.63 0.54 -0.92 0.00 0.00 175.35 176.20 2wvv n ARG 48 N 1.39 2.75 -0.07 1.68 1.74 -1.26 -4.92 116.66 117.98 2wvv n ARG 48 Ca 0.03 0.98 0.05 0.00 -0.77 0.00 0.00 57.85 58.15 2wvv n ARG 48 Cb 0.40 -2.78 0.07 0.00 -1.02 0.00 0.00 32.46 29.13 2wvv n ARG 48 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2wvv n GLN 49 N 2.49 1.75 -1.05 5.56 1.13 -1.26 -4.70 117.38 121.30 2wvv n GLN 49 Ca 0.10 -1.94 -0.31 0.00 -1.94 0.00 0.00 57.00 52.91 2wvv n GLN 49 Cb 0.37 -1.18 0.12 0.00 0.11 0.00 0.00 30.24 29.66 2wvv n GLN 49 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2wvv s ASP 50 N -1.87 3.86 0.40 1.08 -4.77 -1.26 -4.80 116.67 109.31 2wvv s ASP 50 Ca 0.16 2.00 0.06 0.00 -3.30 0.00 0.00 52.55 51.47 2wvv s ASP 50 Cb 0.14 -2.54 0.81 0.00 -1.09 0.00 0.00 42.92 40.24 2wvv s ASP 50 CO 0.01 -2.47 2.03 -0.65 0.70 0.00 0.00 175.17 174.80 2wvv h PRO 51 N -1.37 0.56 -0.54 2.11 0.11 -1.98 -1.30 132.00 129.58 2wvv h PRO 51 Ca -0.44 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2wvv h PRO 51 Cb 1.25 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2wvv h PRO 51 CO 0.47 0.39 0.28 0.00 -0.21 0.00 0.00 178.00 178.94 2wvv h ALA 52 N 1.70 0.69 -0.17 -0.75 0.00 -1.92 -0.13 119.26 118.68 2wvv h ALA 52 Ca 0.15 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 2wvv h ALA 52 Cb -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2wvv h ALA 52 CO -0.03 0.24 -0.49 1.98 0.00 0.00 0.00 179.25 180.94 2wvv h MET 53 N 0.72 0.46 -0.61 0.00 -1.53 -1.70 -1.69 114.93 110.59 2wvv h MET 53 Ca 0.19 -0.27 -0.05 0.00 -3.44 0.00 0.00 59.70 56.13 2wvv h MET 53 Cb 0.09 0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 31.13 2wvv h MET 53 CO -0.03 0.85 0.18 1.96 0.14 0.00 0.00 176.91 180.02 2wvv h GLN 54 N 0.37 0.93 -0.35 0.39 4.20 -0.81 -0.92 115.11 118.91 2wvv h GLN 54 Ca 0.02 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.50 2wvv h GLN 54 Cb 1.00 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 2wvv h GLN 54 CO 0.09 0.81 0.04 -0.22 -0.67 0.00 0.00 178.83 178.88 2wvv h LYS 55 N 0.90 0.60 -0.49 1.46 1.63 -0.83 0.17 116.57 120.00 2wvv h LYS 55 Ca 0.20 -0.17 0.09 0.00 -0.85 0.00 0.00 60.65 59.92 2wvv h LYS 55 Cb 0.27 -0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 31.76 2wvv h LYS 55 CO -0.01 0.68 0.08 0.35 -3.45 0.00 0.00 179.45 177.10 2wvv h PHE 56 N 0.43 0.12 0.07 1.91 3.57 -0.89 -0.97 116.94 121.18 2wvv h PHE 56 Ca 0.11 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 2wvv h PHE 56 Cb 0.38 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2wvv h PHE 56 CO 0.03 -0.03 -0.03 -0.09 -2.23 0.00 0.00 178.31 175.95 2wvv h ARG 57 N 0.21 -0.09 -0.06 1.11 2.43 -1.02 -3.25 114.38 113.70 2wvv h ARG 57 Ca 0.25 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 2wvv h ARG 57 Cb 0.34 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2wvv h ARG 57 CO -0.34 0.39 0.00 -0.44 -1.51 0.00 0.00 179.97 178.07 2wvv h ASP 58 N -0.63 0.07 -0.61 -3.80 3.32 -0.51 -2.02 116.42 112.25 2wvv h ASP 58 Ca -0.01 -0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.15 2wvv h ASP 58 Cb 0.53 -0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.97 2wvv h ASP 58 CO 0.02 0.09 0.14 0.78 -1.72 0.00 0.00 179.24 178.55 2wvv h ASN 59 N 0.09 0.02 0.00 6.45 2.35 -1.21 -0.55 115.58 122.73 2wvv h ASN 59 Ca 0.02 0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2wvv h ASN 59 Cb 0.06 0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2wvv h ASN 59 CO 0.00 0.02 0.00 0.54 -1.65 0.00 0.00 177.43 176.34 2wvv n ARG 60 N -5.12 0.00 -4.13 0.81 5.12 -0.76 -4.58 116.66 108.00 2wvv n ARG 60 Ca 0.09 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.67 2wvv n ARG 60 Cb 0.33 0.00 -0.13 0.00 -1.16 0.00 0.00 32.46 31.49 2wvv n ARG 60 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2wvv s LEU 61 N 0.00 3.07 0.28 0.55 2.96 -1.26 -1.33 118.68 122.95 2wvv s LEU 61 Ca 0.00 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 2wvv s LEU 61 Cb 0.00 -1.77 -0.06 0.00 0.50 0.00 0.00 46.19 44.86 2wvv s LEU 61 CO 0.00 0.06 0.00 -0.83 -1.32 0.00 0.00 176.35 174.26 2wvv s GLY 62 N 1.03 1.80 0.03 7.98 0.00 -0.32 -1.01 107.32 116.83 2wvv s GLY 62 Ca 0.01 -1.90 0.06 0.00 0.00 0.00 0.00 44.72 42.89 2wvv s GLY 62 CO 0.01 -1.76 -0.16 0.00 0.00 0.00 0.00 173.10 171.18 2wvv s ALA 63 N -3.27 2.66 -0.13 3.20 0.00 -0.52 -1.38 121.76 122.31 2wvv s ALA 63 Ca 0.32 -1.15 -0.07 0.00 0.00 0.00 0.00 51.96 51.06 2wvv s ALA 63 Cb 0.06 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 2wvv s ALA 63 CO 0.12 0.58 0.11 0.12 0.00 0.00 0.00 175.76 176.69 2wvv s PHE 64 N -0.92 3.49 -0.25 0.00 5.99 0.15 -0.51 117.98 125.92 2wvv s PHE 64 Ca 0.15 0.43 0.03 0.00 0.00 0.00 0.00 56.93 57.54 2wvv s PHE 64 Cb -0.11 -1.95 0.06 0.00 0.00 0.00 0.00 43.02 41.02 2wvv s PHE 64 CO 0.05 0.61 -0.12 0.42 -0.00 0.00 0.00 175.22 176.19 2wvv s ILE 65 N -0.76 2.15 -0.43 3.12 -1.09 0.31 -0.27 121.20 124.23 2wvv s ILE 65 Ca 0.13 -1.58 -0.16 0.00 -2.23 0.00 0.00 60.65 56.81 2wvv s ILE 65 Cb -0.12 -2.24 0.04 0.00 -1.58 0.00 0.00 42.46 38.56 2wvv s ILE 65 CO 0.03 0.01 0.37 -1.00 -1.23 0.00 0.00 174.94 173.11 2wvv s HIS 66 N 1.12 3.22 -0.04 3.97 3.76 -0.54 -1.55 115.29 125.23 2wvv s HIS 66 Ca -0.08 -0.65 0.00 0.00 -0.15 0.00 0.00 55.06 54.18 2wvv s HIS 66 Cb -0.19 -2.86 0.03 0.00 1.11 0.00 0.00 32.58 30.66 2wvv s HIS 66 CO -0.06 -0.69 0.00 -0.46 -0.85 0.00 0.00 174.74 172.69 2wvv s TRP 67 N 1.80 0.34 0.00 1.40 -0.00 -1.26 -3.68 118.94 117.54 2wvv s TRP 67 Ca 0.06 -0.00 0.00 0.00 -0.00 0.00 0.00 56.10 56.16 2wvv s TRP 67 Cb -0.20 -0.46 0.00 0.00 -0.00 0.00 0.00 33.47 32.81 2wvv s TRP 67 CO 0.10 -0.16 0.00 0.41 -0.00 0.00 0.00 176.95 177.30 2wvv n GLY 68 N 4.33 1.49 0.27 5.86 0.00 -1.26 -4.87 105.19 111.02 2wvv n GLY 68 Ca -0.23 -0.86 0.08 0.00 0.00 0.00 0.00 46.02 45.01 2wvv n GLY 68 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wvv h LEU 69 N 0.00 0.09 -1.86 0.99 3.38 -1.97 -1.70 115.31 114.23 2wvv h LEU 69 Ca 0.00 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2wvv h LEU 69 Cb 0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2wvv h LEU 69 CO 0.00 0.06 0.44 0.10 0.09 0.00 0.00 178.44 179.13 2wvv h TYR 70 N 0.10 0.00 0.00 1.13 -0.00 -1.93 -1.06 116.97 115.22 2wvv h TYR 70 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 58.72 2wvv h TYR 70 Cb 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.75 2wvv h TYR 70 CO -0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 178.16 177.94 2wvv h ALA 71 N 1.32 1.21 0.57 0.10 0.00 -1.57 -1.65 119.26 119.23 2wvv h ALA 71 Ca 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2wvv h ALA 71 Cb 0.99 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.75 2wvv h ALA 71 CO -0.00 0.27 -0.27 0.82 0.00 0.00 0.00 179.25 180.07 2wvv h ILE 72 N 0.00 0.00 0.00 0.00 2.04 -1.40 -3.19 117.51 114.96 2wvv h ILE 72 Ca -0.00 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 2wvv h ILE 72 Cb 0.55 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2wvv h ILE 72 CO 0.03 0.00 -0.26 1.55 0.00 0.00 0.00 178.15 179.47 2wvv h PRO 73 N -1.08 0.00 -6.30 2.37 0.13 -1.72 -3.47 132.00 121.92 2wvv h PRO 73 Ca -0.08 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.58 2wvv h PRO 73 Cb 0.58 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.68 2wvv h PRO 73 CO 0.13 0.26 -0.79 0.41 -0.23 0.00 0.00 178.00 177.78 2wvv n GLY 74 N 0.02 -0.42 1.11 1.56 0.00 -0.62 -2.29 105.19 104.54 2wvv n GLY 74 Ca -0.00 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2wvv n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvv n GLY 75 N -1.67 0.77 3.30 -0.02 0.00 -1.26 -1.00 105.19 105.32 2wvv n GLY 75 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 2wvv n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvv s GLU 76 N -0.63 2.93 -0.06 1.61 2.12 -0.97 -1.07 118.70 122.63 2wvv s GLU 76 Ca 0.00 -0.82 -0.00 0.00 0.36 0.00 0.00 54.97 54.51 2wvv s GLU 76 Cb 0.00 -2.35 0.03 0.00 0.26 0.00 0.00 34.13 32.06 2wvv s GLU 76 CO 0.00 0.30 -0.02 -0.46 -0.54 0.00 0.00 175.26 174.54 2wvv s TRP 77 N 0.07 0.68 -1.41 5.30 -0.11 -0.32 -4.71 118.94 118.43 2wvv s TRP 77 Ca -0.09 -0.18 -0.04 0.00 1.22 0.00 0.00 56.10 57.01 2wvv s TRP 77 Cb -0.15 -0.71 0.03 0.00 -1.50 0.00 0.00 33.47 31.14 2wvv s TRP 77 CO 0.06 -0.25 0.70 0.09 -4.62 0.00 0.00 176.95 172.92 2wvv n ASN 78 N 4.59 -1.92 0.00 5.86 4.13 -1.26 -1.68 115.26 124.98 2wvv n ASN 78 Ca -0.17 -0.87 0.00 0.00 1.68 0.00 0.00 54.58 55.22 2wvv n ASN 78 Cb 0.50 -3.67 0.00 0.00 -1.54 0.00 0.00 39.78 35.07 2wvv n ASN 78 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wvv n GLY 79 N -1.70 2.49 3.54 7.41 0.00 -1.26 -5.00 105.19 110.67 2wvv n GLY 79 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 2wvv n GLY 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wvv s LYS 80 N -0.05 3.81 -0.17 1.61 2.20 -0.67 -5.08 119.74 121.39 2wvv s LYS 80 Ca 0.00 -0.41 -0.25 0.00 -0.36 0.00 0.00 55.97 54.95 2wvv s LYS 80 Cb 0.00 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 33.03 2wvv s LYS 80 CO 0.00 0.03 0.82 0.08 -0.36 0.00 0.00 175.35 175.92 2wvv s VAL 81 N 1.02 4.89 -0.15 4.02 1.01 -1.26 -1.18 120.40 128.75 2wvv s VAL 81 Ca 0.04 1.60 -0.08 0.00 0.00 0.00 0.00 61.98 63.55 2wvv s VAL 81 Cb -0.14 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 2wvv s VAL 81 CO 0.03 0.03 0.12 -0.31 0.00 0.00 0.00 175.10 174.97 2wvv s TYR 82 N 2.14 3.46 -0.41 5.22 2.02 -0.23 -5.00 117.35 124.55 2wvv s TYR 82 Ca 0.38 0.39 0.23 0.00 -0.37 0.00 0.00 57.07 57.69 2wvv s TYR 82 Cb -0.16 -2.02 0.28 0.00 -0.40 0.00 0.00 41.96 39.66 2wvv s TYR 82 CO 0.12 0.50 1.50 0.78 -1.57 0.00 0.00 175.55 176.88 2wvv h GLY 83 N 5.76 0.00 -1.40 0.71 0.00 -1.97 -3.46 103.07 102.71 2wvv h GLY 83 Ca -0.48 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.37 2wvv h GLY 83 CO 0.65 0.00 -0.25 0.61 0.00 0.00 0.00 176.54 177.56 2wvv n GLY 84 N 1.12 -1.60 3.65 4.60 0.00 -1.26 -4.89 105.19 106.81 2wvv n GLY 84 Ca 0.03 -0.88 -0.47 0.00 0.00 0.00 0.00 46.02 44.70 2wvv n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wvv n ALA 85 N -4.39 0.85 -0.01 4.61 0.00 -1.25 -4.87 120.51 115.45 2wvv n ALA 85 Ca 0.06 0.46 0.03 0.00 0.00 0.00 0.00 53.44 53.99 2wvv n ALA 85 Cb 0.55 -2.29 0.39 0.00 0.00 0.00 0.00 19.45 18.09 2wvv n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvv h ALA 86 N 5.69 1.62 0.00 0.00 0.00 -1.84 -1.11 119.26 123.61 2wvv h ALA 86 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2wvv h ALA 86 Cb 1.27 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2wvv h ALA 86 CO 0.87 0.32 0.00 -0.85 0.00 0.00 0.00 179.25 179.59 2wvv n GLU 87 N -4.43 0.02 -0.41 0.00 0.00 -1.26 -1.51 120.64 113.05 2wvv n GLU 87 Ca 0.03 0.30 0.10 0.00 0.00 0.00 0.00 57.16 57.59 2wvv n GLU 87 Cb 0.10 -1.55 0.31 0.00 0.00 0.00 0.00 31.44 30.30 2wvv n GLU 87 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 2wvv n TRP 88 N -1.59 1.04 -0.11 -1.84 7.02 -0.42 -4.65 117.44 116.89 2wvv n TRP 88 Ca 0.03 -0.54 0.10 0.00 -1.02 0.00 0.00 57.50 56.07 2wvv n TRP 88 Cb 0.16 -0.08 0.46 0.00 -2.42 0.00 0.00 31.31 29.42 2wvv n TRP 88 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2wvv h LEU 89 N 3.81 0.45 -0.91 -0.99 5.85 -1.32 -0.29 115.31 121.90 2wvv h LEU 89 Ca 0.00 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.86 2wvv h LEU 89 Cb 1.09 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.95 2wvv h LEU 89 CO 0.07 0.27 0.53 0.50 -0.34 0.00 0.00 178.44 179.47 2wvv h LYS 90 N 0.50 0.76 0.14 1.25 3.64 -1.84 -0.27 116.57 120.76 2wvv h LYS 90 Ca 0.29 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2wvv h LYS 90 Cb 0.46 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2wvv h LYS 90 CO -0.09 0.50 -0.07 1.03 -2.27 0.00 0.00 179.45 178.56 2wvv h SER 91 N 0.78 -0.16 -0.77 4.20 0.87 -1.41 -0.59 113.55 116.48 2wvv h SER 91 Ca 0.48 -0.37 0.05 0.00 -1.23 0.00 0.00 61.79 60.72 2wvv h SER 91 Cb 0.59 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.54 2wvv h SER 91 CO -0.32 0.34 0.47 -0.50 -0.53 0.00 0.00 176.83 176.29 2wvv h TRP 92 N -0.73 0.86 -0.19 2.24 -0.00 -1.03 -2.28 115.95 114.82 2wvv h TRP 92 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.90 2wvv h TRP 92 Cb 0.52 -0.28 0.00 0.00 -0.00 0.00 0.00 29.16 29.40 2wvv h TRP 92 CO 0.08 0.45 0.00 0.00 -0.00 0.00 0.00 178.44 178.97 2wvv n ALA 93 N -2.34 2.50 -3.90 1.49 0.00 -0.14 -4.96 120.51 113.16 2wvv n ALA 93 Ca 0.10 -0.60 -0.26 0.00 0.00 0.00 0.00 53.44 52.68 2wvv n ALA 93 Cb 0.15 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2wvv n ALA 93 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wvv n LYS 94 N 0.54 -4.23 -2.98 0.00 4.76 -0.86 -4.94 118.16 110.45 2wvv n LYS 94 Ca 0.17 0.51 -0.41 0.00 -2.87 0.00 0.00 58.31 55.71 2wvv n LYS 94 Cb 0.38 -4.99 -0.04 0.00 -1.84 0.00 0.00 35.03 28.54 2wvv n LYS 94 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wvv s VAL 95 N -3.67 4.97 0.68 -0.18 1.01 -0.26 -5.04 120.40 117.91 2wvv s VAL 95 Ca 0.21 1.52 -0.16 0.00 0.00 0.00 0.00 61.98 63.55 2wvv s VAL 95 Cb -0.11 -4.08 0.01 0.00 0.00 0.00 0.00 36.38 32.20 2wvv s VAL 95 CO 0.86 0.14 1.21 -2.84 0.00 0.00 0.00 175.10 174.47 2wvv s PRO 96 N 1.46 2.45 0.17 2.72 0.02 -1.26 -4.74 135.00 135.81 2wvv s PRO 96 Ca 0.37 1.78 -0.18 0.00 0.02 0.00 0.00 61.00 62.99 2wvv s PRO 96 Cb -0.17 -1.87 0.09 0.00 0.02 0.00 0.00 34.50 32.57 2wvv s PRO 96 CO 0.16 -1.60 1.65 0.00 -0.33 0.00 0.00 177.00 176.88 2wvv h ALA 97 N 0.12 0.17 -0.52 -1.55 0.00 -1.96 -0.17 119.26 115.34 2wvv h ALA 97 Ca -0.49 0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.62 2wvv h ALA 97 Cb 1.30 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 19.41 2wvv h ALA 97 CO 0.52 -0.51 0.23 -0.44 0.00 0.00 0.00 179.25 179.05 2wvv h ASP 98 N -0.07 0.29 -0.33 0.00 3.45 -1.95 -1.26 116.42 116.55 2wvv h ASP 98 Ca 0.19 0.04 -0.12 0.00 0.43 0.00 0.00 57.03 57.57 2wvv h ASP 98 Cb 0.36 -0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.12 2wvv h ASP 98 CO -0.43 0.20 -0.27 -0.08 -1.57 0.00 0.00 179.24 177.09 2wvv h GLU 99 N 0.44 0.77 -0.49 3.56 4.81 -1.78 -2.68 114.58 119.22 2wvv h GLU 99 Ca 0.24 -0.38 0.02 0.00 -0.13 0.00 0.00 59.36 59.10 2wvv h GLU 99 Cb 0.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2wvv h GLU 99 CO -0.20 1.01 0.30 2.35 -0.73 0.00 0.00 179.01 181.73 2wvv h TRP 100 N 0.54 0.55 0.00 0.92 2.91 -0.75 -2.89 115.95 117.24 2wvv h TRP 100 Ca 0.06 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.10 2wvv h TRP 100 Cb 0.84 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.31 2wvv h TRP 100 CO 0.07 0.32 0.00 -0.07 -1.03 0.00 0.00 178.44 177.73 2wvv h LEU 101 N 0.59 0.00 -2.39 0.65 3.38 -1.17 -1.83 115.31 114.55 2wvv h LEU 101 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2wvv h LEU 101 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2wvv h LEU 101 CO -0.08 0.00 0.04 0.11 0.09 0.00 0.00 178.44 178.60 2wvv h LYS 102 N 0.00 0.00 -0.22 1.13 1.57 -1.25 -1.00 116.57 116.80 2wvv h LYS 102 Ca 0.00 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 2wvv h LYS 102 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2wvv h LYS 102 CO 0.00 0.00 0.35 -0.07 -0.57 0.00 0.00 179.45 179.16 2wvv h LEU 103 N 0.00 0.00 -1.73 2.94 3.38 -1.45 -1.94 115.31 116.50 2wvv h LEU 103 Ca 0.00 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.17 2wvv h LEU 103 Cb 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 2wvv h LEU 103 CO 0.00 0.00 0.56 0.24 0.09 0.00 0.00 178.44 179.33 2wvv h MET 104 N 0.00 0.23 0.00 1.13 2.86 -1.42 -0.10 114.93 117.63 2wvv h MET 104 Ca 0.10 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2wvv h MET 104 Cb 0.80 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.41 2wvv h MET 104 CO -0.00 0.15 0.00 -0.44 1.06 0.00 0.00 176.91 177.68 2wvv h ASP 105 N 0.24 0.00 -0.13 1.22 3.32 -1.59 -1.90 116.42 117.57 2wvv h ASP 105 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 2wvv h ASP 105 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2wvv h ASP 105 CO -0.09 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.43 2wvv n GLN 106 N -2.48 1.49 -2.33 3.56 6.02 -0.07 -4.75 117.38 118.83 2wvv n GLN 106 Ca 0.01 -1.58 -0.40 0.00 -0.01 0.00 0.00 57.00 55.01 2wvv n GLN 106 Cb 0.19 -1.29 -0.03 0.00 1.02 0.00 0.00 30.24 30.12 2wvv n GLN 106 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2wvv s TRP 107 N -1.14 2.01 -0.45 1.08 -0.11 -0.71 -4.82 118.94 114.81 2wvv s TRP 107 Ca 0.20 0.32 0.07 0.00 1.22 0.00 0.00 56.10 57.91 2wvv s TRP 107 Cb 0.13 -4.39 0.26 0.00 -1.50 0.00 0.00 33.47 27.97 2wvv s TRP 107 CO 0.18 -2.18 0.80 -1.71 -4.62 0.00 0.00 176.95 169.42 2wvv n ASN 108 N 10.85 -1.60 -4.25 5.86 5.15 -1.26 -3.01 115.26 126.99 2wvv n ASN 108 Ca 0.11 -3.15 -0.37 0.00 -0.60 0.00 0.00 54.58 50.56 2wvv n ASN 108 Cb 0.50 0.91 -0.04 0.00 -0.53 0.00 0.00 39.78 40.62 2wvv n ASN 108 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2wvv n PRO 109 N 1.30 2.19 -0.31 1.20 -0.04 -1.26 -4.78 135.00 133.29 2wvv n PRO 109 Ca 0.14 -2.57 0.21 0.00 -0.04 0.00 0.00 63.50 61.23 2wvv n PRO 109 Cb 0.61 -3.43 0.48 0.00 -0.04 0.00 0.00 33.50 31.12 2wvv n PRO 109 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wvv h THR 110 N 5.33 0.58 -0.00 0.52 1.03 -1.83 -1.68 112.91 116.85 2wvv h THR 110 Ca 0.37 -0.16 0.00 0.00 -0.01 0.00 0.00 66.41 66.62 2wvv h THR 110 Cb 0.82 0.09 0.00 0.00 -1.07 0.00 0.00 68.15 67.98 2wvv h THR 110 CO 1.54 0.08 -0.11 0.29 -0.01 0.00 0.00 175.52 177.31 2wvv n LYS 111 N -4.63 0.73 -1.69 0.00 5.02 0.06 -4.92 118.16 112.72 2wvv n LYS 111 Ca 0.24 -0.26 -0.44 0.00 -2.02 0.00 0.00 58.31 55.83 2wvv n LYS 111 Cb 0.80 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.28 2wvv n LYS 111 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wvv n PHE 112 N -0.91 2.48 -3.42 2.13 7.35 -0.63 -4.60 117.46 119.86 2wvv n PHE 112 Ca 0.15 0.17 -0.14 0.00 -0.76 0.00 0.00 57.45 56.86 2wvv n PHE 112 Cb 0.28 -2.60 -0.10 0.00 0.35 0.00 0.00 39.48 37.40 2wvv n PHE 112 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2wvv s ASP 113 N 1.04 0.91 0.29 -2.13 -1.08 -1.26 -5.04 116.67 109.40 2wvv s ASP 113 Ca 0.77 -0.10 0.00 0.00 -0.52 0.00 0.00 52.55 52.71 2wvv s ASP 113 Cb -0.60 0.72 0.45 0.00 -1.46 0.00 0.00 42.92 42.03 2wvv s ASP 113 CO 0.35 -0.32 1.83 0.00 0.52 0.00 0.00 175.17 177.56 2wvv h ALA 114 N 8.25 1.25 -0.63 3.66 0.00 -1.94 -1.90 119.26 127.95 2wvv h ALA 114 Ca -0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 2wvv h ALA 114 Cb 1.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 2wvv h ALA 114 CO 0.28 0.52 0.30 0.87 0.00 0.00 0.00 179.25 181.22 2wvv h LYS 115 N 0.72 0.90 -0.32 0.00 1.57 -1.92 -0.80 116.57 116.72 2wvv h LYS 115 Ca 0.16 -0.12 -0.15 0.00 -1.87 0.00 0.00 60.65 58.67 2wvv h LYS 115 Cb 0.31 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2wvv h LYS 115 CO 0.00 0.70 -0.40 -0.22 -0.57 0.00 0.00 179.45 178.96 2wvv h LYS 116 N 0.90 0.78 -0.56 3.15 3.64 -1.82 -1.09 116.57 121.57 2wvv h LYS 116 Ca 0.22 -0.41 -0.02 0.00 -1.27 0.00 0.00 60.65 59.17 2wvv h LYS 116 Cb 0.10 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2wvv h LYS 116 CO -0.03 1.04 0.29 -1.49 -2.27 0.00 0.00 179.45 176.99 2wvv h TRP 117 N 0.64 0.78 -0.39 1.91 4.06 -1.02 -1.36 115.95 120.58 2wvv h TRP 117 Ca 0.05 -0.03 -0.10 0.00 2.06 0.00 0.00 58.89 60.88 2wvv h TRP 117 Cb 0.96 -0.25 -0.02 0.00 -1.00 0.00 0.00 29.16 28.85 2wvv h TRP 117 CO 0.05 0.59 -0.15 0.00 -3.56 0.00 0.00 178.44 175.37 2wvv h ALA 118 N 1.12 1.01 -0.36 1.49 0.00 -0.97 -2.36 119.26 119.19 2wvv h ALA 118 Ca 0.19 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.65 2wvv h ALA 118 Cb 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2wvv h ALA 118 CO -0.03 0.59 -0.29 0.87 0.00 0.00 0.00 179.25 180.39 2wvv h LYS 119 N 0.64 0.75 -0.66 0.00 1.79 -0.97 -0.74 116.57 117.37 2wvv h LYS 119 Ca 0.10 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 2wvv h LYS 119 Cb 0.62 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.22 2wvv h LYS 119 CO 0.04 0.95 0.43 1.98 -1.08 0.00 0.00 179.45 181.77 2wvv h MET 120 N 0.64 0.88 -0.39 3.15 4.05 -0.99 -0.10 114.93 122.18 2wvv h MET 120 Ca 0.08 -0.06 -0.07 0.00 -0.28 0.00 0.00 59.70 59.36 2wvv h MET 120 Cb 0.81 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.41 2wvv h MET 120 CO 0.07 0.60 -0.04 0.00 0.23 0.00 0.00 176.91 177.77 2wvv h ALA 121 N 1.23 0.53 -0.61 0.39 0.00 -1.24 -1.81 119.26 117.75 2wvv h ALA 121 Ca 0.24 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2wvv h ALA 121 Cb -0.08 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2wvv h ALA 121 CO -0.05 0.34 0.38 -0.22 0.00 0.00 0.00 179.25 179.70 2wvv h LYS 122 N 0.53 0.82 0.00 0.00 3.64 -0.79 -2.06 116.57 118.71 2wvv h LYS 122 Ca 0.11 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2wvv h LYS 122 Cb 0.53 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2wvv h LYS 122 CO 0.03 0.58 -0.17 0.93 -2.27 0.00 0.00 179.45 178.54 2wvv h GLU 123 N 0.82 0.00 0.00 1.90 5.08 -0.91 -2.23 114.58 119.24 2wvv h GLU 123 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2wvv h GLU 123 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2wvv h GLU 123 CO -0.04 0.17 0.00 1.98 -1.00 0.00 0.00 179.01 180.12 2wvv h MET 124 N 0.00 0.00 0.00 2.33 4.05 -0.62 -3.37 114.93 117.32 2wvv h MET 124 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2wvv h MET 124 Cb 0.49 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.29 2wvv h MET 124 CO 0.02 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.57 2wvv n GLY 125 N 0.72 0.70 3.76 1.39 0.00 -0.84 -3.05 105.19 107.87 2wvv n GLY 125 Ca 0.03 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 2wvv n GLY 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvv s THR 126 N -2.00 3.39 -0.83 2.61 -4.23 -1.03 -4.88 115.64 108.67 2wvv s THR 126 Ca 0.00 1.35 0.20 0.00 -1.18 0.00 0.00 61.69 62.05 2wvv s THR 126 Cb 0.00 -3.86 -0.22 0.00 1.34 0.00 0.00 72.50 69.76 2wvv s THR 126 CO 0.00 0.30 0.79 0.29 -0.54 0.00 0.00 174.62 175.46 2wvv n LYS 127 N 1.41 0.54 -3.66 3.99 4.76 -0.18 -4.64 118.16 120.38 2wvv n LYS 127 Ca 0.00 -0.02 -0.10 0.00 -2.87 0.00 0.00 58.31 55.32 2wvv n LYS 127 Cb 0.44 -1.43 -0.04 0.00 -1.84 0.00 0.00 35.03 32.16 2wvv n LYS 127 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2wvv s TYR 128 N -2.91 -0.18 -0.01 2.13 -0.85 -1.23 -2.09 117.35 112.21 2wvv s TYR 128 Ca 0.06 -0.13 0.03 0.00 -0.52 0.00 0.00 57.07 56.50 2wvv s TYR 128 Cb 0.15 0.31 -0.01 0.00 0.38 0.00 0.00 41.96 42.79 2wvv s TYR 128 CO 0.81 -0.78 -0.09 0.08 -1.52 0.00 0.00 175.55 174.05 2wvv s VAL 129 N -3.83 0.69 -0.21 -3.49 1.01 -0.52 -1.44 120.40 112.61 2wvv s VAL 129 Ca 0.05 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 2wvv s VAL 129 Cb 0.01 -0.58 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 2wvv s VAL 129 CO -0.09 0.20 -0.06 -0.54 0.00 0.00 0.00 175.10 174.61 2wvv s LYS 130 N -0.19 3.35 -0.10 2.72 1.02 0.33 -0.44 119.74 126.44 2wvv s LYS 130 Ca 0.03 -0.64 0.01 0.00 0.02 0.00 0.00 55.97 55.39 2wvv s LYS 130 Cb -0.04 -2.97 -0.02 0.00 -0.52 0.00 0.00 37.83 34.29 2wvv s LYS 130 CO -0.00 -0.19 -0.11 0.42 -0.92 0.00 0.00 175.35 174.55 2wvv s ILE 131 N 1.43 3.28 -0.53 2.17 1.01 -0.31 -0.53 121.20 127.72 2wvv s ILE 131 Ca 0.05 -0.61 -0.27 0.00 0.00 0.00 0.00 60.65 59.83 2wvv s ILE 131 Cb -0.14 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 2wvv s ILE 131 CO -0.04 0.55 1.93 0.42 0.00 0.00 0.00 174.94 177.81 2wvv s THR 132 N -0.19 3.33 0.17 2.92 -4.23 -0.59 -0.64 115.64 116.41 2wvv s THR 132 Ca 0.01 0.23 -0.04 0.00 -1.18 0.00 0.00 61.69 60.71 2wvv s THR 132 Cb -0.13 -3.73 -0.09 0.00 1.34 0.00 0.00 72.50 69.89 2wvv s THR 132 CO 0.03 -0.66 1.45 0.71 -0.54 0.00 0.00 174.62 175.60 2wvv h THR 133 N 6.99 1.33 -2.02 3.99 1.35 -1.69 -3.44 112.91 119.43 2wvv h THR 133 Ca -0.27 -1.93 0.05 0.00 -0.55 0.00 0.00 66.41 63.70 2wvv h THR 133 Cb 1.18 1.91 -0.21 0.00 -1.73 0.00 0.00 68.15 69.30 2wvv h THR 133 CO 1.17 0.60 -0.07 -0.75 -0.25 0.00 0.00 175.52 176.21 2wvv s LYS 134 N -3.84 0.63 0.14 4.72 2.20 -1.26 -0.72 119.74 121.62 2wvv s LYS 134 Ca -0.07 1.35 0.02 0.00 -0.36 0.00 0.00 55.97 56.90 2wvv s LYS 134 Cb 0.11 0.55 0.03 0.00 -1.51 0.00 0.00 37.83 37.00 2wvv s LYS 134 CO 0.85 -0.18 0.20 1.58 -0.36 0.00 0.00 175.35 177.44 2wvv n HIS 135 N 4.96 -2.93 -0.08 4.03 -0.00 -1.26 -1.71 115.22 118.22 2wvv n HIS 135 Ca -0.15 -0.48 0.05 0.00 -0.00 0.00 0.00 57.72 57.14 2wvv n HIS 135 Cb 0.53 -0.14 0.39 0.00 -0.00 0.00 0.00 29.99 30.78 2wvv n HIS 135 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2wvv h HIS 136 N -0.08 0.62 -0.20 1.57 -0.00 -1.91 -0.00 115.15 115.15 2wvv h HIS 136 Ca -0.07 0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.38 2wvv h HIS 136 Cb 0.29 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.49 2wvv h HIS 136 CO 0.00 0.36 0.17 1.05 -0.00 0.00 0.00 177.93 179.52 2wvv h GLU 137 N 0.65 0.00 0.00 2.45 4.11 -1.88 0.39 114.58 120.30 2wvv h GLU 137 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 2wvv h GLU 137 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2wvv h GLU 137 CO -0.06 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.43 2wvv n GLY 138 N -1.48 0.83 3.69 1.06 0.00 -0.02 -3.52 105.19 105.75 2wvv n GLY 138 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2wvv n GLY 138 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wvv s PHE 139 N -2.51 2.73 -0.08 1.61 5.36 -1.26 -4.85 117.98 118.97 2wvv s PHE 139 Ca 0.00 0.70 -0.14 0.00 -0.96 0.00 0.00 56.93 56.53 2wvv s PHE 139 Cb 0.00 -3.73 -0.05 0.00 -0.34 0.00 0.00 43.02 38.90 2wvv s PHE 139 CO 0.00 -2.78 0.34 0.00 -1.46 0.00 0.00 175.22 171.32 2wvv n LEU 141 N 2.63 0.78 -4.32 0.00 4.77 0.10 -1.60 117.00 119.36 2wvv n LEU 141 Ca -0.13 -0.31 -0.19 0.00 -0.03 0.00 0.00 56.01 55.35 2wvv n LEU 141 Cb 0.52 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.47 2wvv n LEU 141 CO 0.38 0.15 -0.45 -1.66 -1.33 0.00 0.00 177.39 174.49 2wvv s TRP 142 N -1.93 1.65 -1.40 -1.77 -2.14 -1.26 -1.33 118.94 110.76 2wvv s TRP 142 Ca 0.34 -0.57 -0.14 0.00 2.66 0.00 0.00 56.10 58.39 2wvv s TRP 142 Cb 0.17 -0.79 0.07 0.00 -3.10 0.00 0.00 33.47 29.81 2wvv s TRP 142 CO 0.27 0.30 2.07 -0.35 -2.66 0.00 0.00 176.95 176.58 2wvv n PRO 143 N -0.11 3.03 -1.89 3.25 -0.04 -1.26 -4.33 135.00 133.64 2wvv n PRO 143 Ca -0.10 -2.88 -0.40 0.00 -0.04 0.00 0.00 63.50 60.07 2wvv n PRO 143 Cb 0.59 -3.28 0.00 0.00 -0.04 0.00 0.00 33.50 30.78 2wvv n PRO 143 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wvv s SER 144 N 3.10 6.18 0.00 3.54 0.15 -1.26 -4.90 113.70 120.51 2wvv s SER 144 Ca 0.47 2.86 0.30 0.00 0.70 0.00 0.00 55.95 60.28 2wvv s SER 144 Cb 0.11 -2.65 1.41 0.00 -1.71 0.00 0.00 66.02 63.18 2wvv s SER 144 CO -0.04 -0.96 1.99 2.29 1.20 0.00 0.00 173.24 177.72 2wvv n LYS 145 N 0.14 0.41 0.00 5.44 2.85 -1.26 -4.10 118.16 121.64 2wvv n LYS 145 Ca 0.03 -0.04 0.12 0.00 -1.05 0.00 0.00 58.31 57.37 2wvv n LYS 145 Cb 0.42 -1.50 0.09 0.00 -0.65 0.00 0.00 35.03 33.39 2wvv n LYS 145 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wvv n TYR 146 N -1.26 0.00 -3.59 5.58 4.01 -1.26 -4.95 117.16 115.70 2wvv n TYR 146 Ca 0.13 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.73 2wvv n TYR 146 Cb 0.26 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.24 2wvv n TYR 146 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2wvv s THR 147 N -2.03 0.03 -1.43 -0.72 -1.32 -1.26 -5.02 115.64 103.89 2wvv s THR 147 Ca 0.27 -0.25 0.28 0.00 -1.21 0.00 0.00 61.69 60.78 2wvv s THR 147 Cb 0.20 -0.95 0.34 0.00 -1.51 0.00 0.00 72.50 70.57 2wvv s THR 147 CO 0.32 -0.14 1.79 2.29 -2.21 0.00 0.00 174.62 176.68 2wvv n LYS 148 N 0.53 0.45 -2.56 7.08 2.85 -1.26 -4.58 118.16 120.67 2wvv n LYS 148 Ca -0.19 -0.16 -0.43 0.00 -1.05 0.00 0.00 58.31 56.49 2wvv n LYS 148 Cb 0.60 -1.50 0.01 0.00 -0.65 0.00 0.00 35.03 33.48 2wvv n LYS 148 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wvv n TYR 149 N -1.13 2.98 -4.21 5.58 4.01 -1.26 -4.67 117.16 118.45 2wvv n TYR 149 Ca 0.12 -2.81 -0.12 0.00 -0.16 0.00 0.00 57.90 54.92 2wvv n TYR 149 Cb 0.30 -1.79 -0.10 0.00 -0.31 0.00 0.00 39.34 37.43 2wvv n TYR 149 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2wvv s THR 150 N -0.33 0.20 0.55 -0.72 -4.23 -1.26 -1.02 115.64 108.83 2wvv s THR 150 Ca 0.38 -1.98 0.25 0.00 -1.18 0.00 0.00 61.69 59.16 2wvv s THR 150 Cb 0.07 -2.39 0.35 0.00 1.34 0.00 0.00 72.50 71.88 2wvv s THR 150 CO 0.03 -0.15 2.08 -0.37 -0.54 0.00 0.00 174.62 175.66 2wvv h VAL 151 N 2.64 0.68 -0.06 2.29 -1.51 -1.49 -1.93 116.25 116.86 2wvv h VAL 151 Ca -0.36 0.00 0.02 0.00 -1.23 0.00 0.00 66.70 65.13 2wvv h VAL 151 Cb 1.23 0.85 -0.00 0.00 -2.13 0.00 0.00 31.29 31.24 2wvv h VAL 151 CO 0.57 0.00 0.05 0.00 -1.23 0.00 0.00 177.57 176.96 2wvv h ALA 152 N 1.81 2.06 -0.91 5.19 0.00 -1.84 -2.93 119.26 122.64 2wvv h ALA 152 Ca 0.12 -0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.44 2wvv h ALA 152 Cb 0.53 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.03 2wvv h ALA 152 CO -0.00 -0.08 0.52 0.09 0.00 0.00 0.00 179.25 179.78 2wvv n ASN 153 N -4.51 5.96 -4.47 0.00 3.02 -0.73 -4.58 115.26 109.95 2wvv n ASN 153 Ca -0.01 -3.75 -0.23 0.00 -0.03 0.00 0.00 54.58 50.56 2wvv n ASN 153 Cb 0.15 -0.83 -0.10 0.00 -0.61 0.00 0.00 39.78 38.38 2wvv n ASN 153 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2wvv s THR 154 N -4.30 1.84 0.42 3.41 -4.23 -1.11 -4.80 115.64 106.87 2wvv s THR 154 Ca 0.59 -2.15 0.19 0.00 -1.18 0.00 0.00 61.69 59.14 2wvv s THR 154 Cb 0.48 -2.53 0.39 0.00 1.34 0.00 0.00 72.50 72.18 2wvv s THR 154 CO 0.02 -0.26 1.83 -0.65 -0.54 0.00 0.00 174.62 175.03 2wvv h PRO 155 N 2.18 0.37 -0.04 3.99 0.11 -1.75 -2.40 132.00 134.46 2wvv h PRO 155 Ca -0.41 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.51 2wvv h PRO 155 Cb 1.24 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2wvv h PRO 155 CO 0.68 0.25 -0.73 -0.92 -0.21 0.00 0.00 178.00 177.07 2wvv h TYR 156 N 0.38 0.33 0.00 0.65 3.20 -1.83 -3.47 116.97 116.24 2wvv h TYR 156 Ca 0.51 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 62.23 2wvv h TYR 156 Cb 1.31 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.53 2wvv h TYR 156 CO -0.00 0.89 0.00 1.63 -1.64 0.00 0.00 178.16 179.04 2wvv n LYS 157 N -3.78 0.00 -2.31 1.82 5.02 -0.91 -4.93 118.16 113.07 2wvv n LYS 157 Ca -0.03 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.89 2wvv n LYS 157 Cb 0.71 -1.27 -0.01 0.00 -0.02 0.00 0.00 35.03 34.44 2wvv n LYS 157 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wvv s ARG 158 N 0.00 3.77 -1.10 1.97 0.52 -1.26 -3.97 118.95 118.87 2wvv s ARG 158 Ca 0.00 1.69 -0.22 0.00 -0.52 0.00 0.00 55.73 56.68 2wvv s ARG 158 Cb 0.00 -2.36 -0.01 0.00 0.52 0.00 0.00 34.95 33.10 2wvv s ARG 158 CO 0.00 -0.53 1.78 0.34 0.02 0.00 0.00 175.30 176.92 2wvv s ASP 159 N -1.48 5.81 0.15 0.23 2.15 -1.26 -4.70 116.67 117.57 2wvv s ASP 159 Ca 0.64 -1.53 -0.20 0.00 0.43 0.00 0.00 52.55 51.89 2wvv s ASP 159 Cb -0.26 -2.57 0.04 0.00 -0.30 0.00 0.00 42.92 39.82 2wvv s ASP 159 CO 0.32 -2.20 1.65 0.40 -0.17 0.00 0.00 175.17 175.18 2wvv h ILE 160 N 6.47 0.53 -0.33 4.11 1.08 -1.90 -1.61 117.51 125.85 2wvv h ILE 160 Ca 0.23 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.73 2wvv h ILE 160 Cb 0.96 0.53 -0.03 0.00 -3.07 0.00 0.00 36.82 35.21 2wvv h ILE 160 CO 1.32 0.00 0.15 0.25 -0.69 0.00 0.00 178.15 179.19 2wvv h LEU 161 N -0.14 0.22 -1.27 1.44 5.85 -1.53 -0.82 115.31 119.06 2wvv h LEU 161 Ca 0.14 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 2wvv h LEU 161 Cb 0.36 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2wvv h LEU 161 CO -0.35 0.16 0.27 1.23 -0.34 0.00 0.00 178.44 179.41 2wvv h GLY 162 N 0.32 0.82 1.10 3.75 0.00 -1.75 -0.40 103.07 106.92 2wvv h GLY 162 Ca 0.14 -0.37 -0.10 0.00 0.00 0.00 0.00 47.33 47.00 2wvv h GLY 162 CO -0.11 0.36 -0.02 0.83 0.00 0.00 0.00 176.54 177.60 2wvv h GLU 163 N 0.77 1.07 -0.40 4.80 5.08 -0.66 -2.44 114.58 122.81 2wvv h GLU 163 Ca 0.19 -0.35 -0.12 0.00 -1.00 0.00 0.00 59.36 58.09 2wvv h GLU 163 Cb 0.08 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2wvv h GLU 163 CO -0.03 1.05 -0.21 -0.07 -1.00 0.00 0.00 179.01 178.75 2wvv h LEU 164 N 0.97 0.88 -0.07 1.33 3.38 -0.61 -1.86 115.31 119.33 2wvv h LEU 164 Ca 0.17 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2wvv h LEU 164 Cb 0.58 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2wvv h LEU 164 CO 0.03 1.10 0.05 0.58 0.09 0.00 0.00 178.44 180.29 2wvv h VAL 165 N 0.66 1.02 -0.22 1.22 2.07 -0.99 -0.25 116.25 119.77 2wvv h VAL 165 Ca 0.09 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.58 2wvv h VAL 165 Cb 0.77 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2wvv h VAL 165 CO 0.06 0.02 0.11 0.50 0.02 0.00 0.00 177.57 178.28 2wvv h LYS 166 N 0.09 0.22 -0.44 1.57 1.63 -1.42 -1.68 116.57 116.53 2wvv h LYS 166 Ca 0.03 -0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 59.71 2wvv h LYS 166 Cb -0.01 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.56 2wvv h LYS 166 CO -0.01 0.15 -0.11 0.00 -3.45 0.00 0.00 179.45 176.03 2wvv h ALA 167 N 1.11 0.61 -0.30 5.00 0.00 -1.02 -0.39 119.26 124.27 2wvv h ALA 167 Ca 0.09 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2wvv h ALA 167 Cb 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2wvv h ALA 167 CO -0.06 0.51 0.02 1.88 0.00 0.00 0.00 179.25 181.60 2wvv h TYR 168 N 0.69 0.55 -0.49 0.00 0.05 -1.04 -2.92 116.97 113.82 2wvv h TYR 168 Ca 0.11 -0.09 -0.04 0.00 0.05 0.00 0.00 58.73 58.77 2wvv h TYR 168 Cb 0.65 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 2wvv h TYR 168 CO 0.05 0.63 0.15 -0.91 -1.05 0.00 0.00 178.16 177.03 2wvv h ASN 169 N 0.32 0.65 0.14 3.88 2.35 -1.15 -1.31 115.58 120.46 2wvv h ASN 169 Ca 0.09 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 2wvv h ASN 169 Cb 0.39 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 2wvv h ASN 169 CO 0.01 0.62 -0.13 0.44 -1.65 0.00 0.00 177.43 176.72 2wvv h ASP 170 N 0.70 0.00 -0.05 5.81 3.32 -0.94 -0.44 116.42 124.82 2wvv h ASP 170 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2wvv h ASP 170 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2wvv h ASP 170 CO -0.01 0.13 0.00 -0.62 -1.72 0.00 0.00 179.24 177.02 2wvv n GLU 171 N -4.32 1.33 -1.84 3.56 -0.58 -0.65 -4.92 120.64 113.22 2wvv n GLU 171 Ca -0.03 -0.49 -0.02 0.00 -0.42 0.00 0.00 57.16 56.20 2wvv n GLU 171 Cb 0.20 -1.40 -0.00 0.00 -0.57 0.00 0.00 31.44 29.67 2wvv n GLU 171 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wvv n GLY 172 N 1.00 0.33 3.50 0.62 0.00 -0.17 -5.01 105.19 105.46 2wvv n GLY 172 Ca 0.18 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 2wvv n GLY 172 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvv s ILE 173 N -2.11 3.99 0.48 -0.61 1.01 -0.59 -4.97 121.20 118.40 2wvv s ILE 173 Ca 0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 60.65 60.12 2wvv s ILE 173 Cb 0.00 -2.76 -0.08 0.00 0.01 0.00 0.00 42.46 39.63 2wvv s ILE 173 CO 0.00 0.48 1.09 -1.81 0.00 0.00 0.00 174.94 174.70 2wvv s ASP 174 N 0.47 6.23 -0.10 3.58 1.01 -0.89 -3.47 116.67 123.50 2wvv s ASP 174 Ca -0.02 2.09 0.02 0.00 0.71 0.00 0.00 52.55 55.35 2wvv s ASP 174 Cb -0.14 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.20 2wvv s ASP 174 CO 0.02 -0.87 -0.18 -0.69 0.21 0.00 0.00 175.17 173.67 2wvv s VAL 175 N -1.77 2.64 0.07 -1.27 1.01 -1.26 -1.44 120.40 118.37 2wvv s VAL 175 Ca 0.66 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.89 2wvv s VAL 175 Cb -0.22 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 2wvv s VAL 175 CO 0.26 0.55 -0.19 -1.00 0.00 0.00 0.00 175.10 174.73 2wvv s HIS 176 N 0.11 2.54 -0.27 5.22 3.76 0.42 -1.33 115.29 125.73 2wvv s HIS 176 Ca -0.09 -0.27 -0.07 0.00 -0.15 0.00 0.00 55.06 54.48 2wvv s HIS 176 Cb -0.15 -1.42 -0.01 0.00 1.11 0.00 0.00 32.58 32.11 2wvv s HIS 176 CO 0.05 0.29 0.08 -0.06 -0.85 0.00 0.00 174.74 174.26 2wvv s PHE 177 N -0.99 3.11 0.22 1.40 0.08 0.17 -1.16 117.98 120.80 2wvv s PHE 177 Ca 0.16 -0.65 -0.30 0.00 0.12 0.00 0.00 56.93 56.26 2wvv s PHE 177 Cb -0.10 -2.25 -0.09 0.00 -0.57 0.00 0.00 43.02 40.01 2wvv s PHE 177 CO 0.07 -0.45 1.16 -0.47 -0.10 0.00 0.00 175.22 175.42 2wvv s TYR 178 N 1.57 3.48 -0.07 0.36 5.04 0.19 -0.59 117.35 127.32 2wvv s TYR 178 Ca 0.05 1.53 -0.03 0.00 -2.44 0.00 0.00 57.07 56.18 2wvv s TYR 178 Cb -0.16 -3.38 0.04 0.00 0.35 0.00 0.00 41.96 38.82 2wvv s TYR 178 CO 0.03 -0.96 0.15 0.12 -1.34 0.00 0.00 175.55 173.55 2wvv s PHE 179 N -0.45 -0.16 -0.18 4.97 5.36 -0.38 -1.72 117.98 125.41 2wvv s PHE 179 Ca 0.50 0.54 -0.22 0.00 -0.96 0.00 0.00 56.93 56.79 2wvv s PHE 179 Cb -0.32 -0.22 -0.02 0.00 -0.34 0.00 0.00 43.02 42.12 2wvv s PHE 179 CO 0.38 -0.23 0.67 0.45 -1.46 0.00 0.00 175.22 175.04 2wvv s SER 180 N 1.92 6.76 -0.04 6.13 0.15 -0.70 -1.45 113.70 126.47 2wvv s SER 180 Ca -0.01 0.92 -0.25 0.00 0.70 0.00 0.00 55.95 57.31 2wvv s SER 180 Cb -0.12 -2.37 -0.21 0.00 -1.71 0.00 0.00 66.02 61.61 2wvv s SER 180 CO -0.06 -0.29 1.13 0.58 1.20 0.00 0.00 173.24 175.81 2wvv h VAL 181 N 5.15 1.49 -2.38 4.45 2.07 -1.34 -3.43 116.25 122.27 2wvv h VAL 181 Ca -0.32 -1.57 -0.58 0.00 0.82 0.00 0.00 66.70 65.05 2wvv h VAL 181 Cb 1.14 2.49 0.06 0.00 -1.52 0.00 0.00 31.29 33.47 2wvv h VAL 181 CO 0.79 0.42 0.76 0.80 0.02 0.00 0.00 177.57 180.36 2wvv n MET 182 N -4.69 2.14 -3.58 1.57 0.00 -0.74 -4.96 117.12 106.86 2wvv n MET 182 Ca -0.09 0.77 -0.26 0.00 -0.00 0.00 0.00 57.70 58.13 2wvv n MET 182 Cb 0.37 -2.51 -0.16 0.00 0.00 0.00 0.00 33.22 30.91 2wvv n MET 182 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2wvv s ASP 183 N 0.77 2.41 0.00 6.12 -1.08 -1.26 -4.35 116.67 119.28 2wvv s ASP 183 Ca 0.76 -0.68 0.23 0.00 -0.52 0.00 0.00 52.55 52.35 2wvv s ASP 183 Cb -0.67 -0.18 1.01 0.00 -1.46 0.00 0.00 42.92 41.62 2wvv s ASP 183 CO 0.40 -0.36 1.74 0.79 0.52 0.00 0.00 175.17 178.26 2wvv n TRP 184 N 5.28 0.00 0.70 -5.34 8.01 0.14 -3.34 117.44 122.89 2wvv n TRP 184 Ca -0.07 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.24 2wvv n TRP 184 Cb 0.48 -0.47 0.07 0.00 -2.01 0.00 0.00 31.31 29.38 2wvv n TRP 184 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2wvv n SER 185 N -1.47 0.64 -4.33 -0.99 3.41 -1.23 -4.82 113.62 104.83 2wvv n SER 185 Ca 0.06 -0.27 -0.38 0.00 -0.26 0.00 0.00 58.87 58.02 2wvv n SER 185 Cb 0.26 0.65 -0.12 0.00 -0.26 0.00 0.00 64.21 64.74 2wvv n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2wvv s ASN 186 N -3.67 5.27 0.09 4.04 3.84 -1.21 -4.98 114.94 118.32 2wvv s ASN 186 Ca 0.06 -0.88 0.12 0.00 0.21 0.00 0.00 52.86 52.38 2wvv s ASN 186 Cb 0.15 -1.90 0.57 0.00 -0.55 0.00 0.00 41.25 39.52 2wvv s ASN 186 CO 0.78 -0.26 1.39 -0.81 -2.79 0.00 0.00 177.10 175.41 2wvv n PRO 187 N 4.87 0.05 0.05 0.43 -0.04 -1.26 -1.59 135.00 137.52 2wvv n PRO 187 Ca -0.13 0.42 0.13 0.00 -0.04 0.00 0.00 63.50 63.87 2wvv n PRO 187 Cb 0.47 -1.63 0.50 0.00 -0.04 0.00 0.00 33.50 32.79 2wvv n PRO 187 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2wvv n ASP 188 N -1.74 0.40 -4.77 3.54 8.00 -1.26 -4.81 116.55 115.91 2wvv n ASP 188 Ca 0.01 0.54 -0.40 0.00 0.71 0.00 0.00 54.79 55.65 2wvv n ASP 188 Cb 0.11 -0.65 0.01 0.00 -0.02 0.00 0.00 41.12 40.56 2wvv n ASP 188 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2wvv s TYR 189 N -3.07 2.55 0.01 1.24 5.04 -0.62 -3.74 117.35 118.77 2wvv s TYR 189 Ca 0.11 1.22 0.04 0.00 -2.44 0.00 0.00 57.07 56.00 2wvv s TYR 189 Cb 0.15 -3.96 -0.01 0.00 0.35 0.00 0.00 41.96 38.48 2wvv s TYR 189 CO 0.53 -2.91 -0.12 1.03 -1.34 0.00 0.00 175.55 172.73 2wvv s ARG 190 N -2.23 0.93 0.23 4.97 1.81 -1.26 -4.99 118.95 118.40 2wvv s ARG 190 Ca 0.56 -0.54 0.15 0.00 -1.72 0.00 0.00 55.73 54.18 2wvv s ARG 190 Cb -0.45 -0.90 0.02 0.00 -0.45 0.00 0.00 34.95 33.17 2wvv s ARG 190 CO 0.60 0.24 1.31 1.88 -0.68 0.00 0.00 175.30 178.65 2wvv h TYR 191 N 5.49 0.00 -3.40 -0.53 -1.99 -1.98 -3.42 116.97 111.14 2wvv h TYR 191 Ca -0.35 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.33 2wvv h TYR 191 Cb 1.17 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.78 2wvv h TYR 191 CO 0.45 0.52 -0.07 0.34 -0.00 0.00 0.00 178.16 179.40 2wvv s ASP 192 N -6.31 -0.23 -0.42 3.88 -1.08 -1.26 -2.07 116.67 109.18 2wvv s ASP 192 Ca 0.03 -0.35 -0.07 0.00 -0.52 0.00 0.00 52.55 51.64 2wvv s ASP 192 Cb 0.08 0.48 0.10 0.00 -1.46 0.00 0.00 42.92 42.12 2wvv s ASP 192 CO 0.76 -0.87 0.25 -0.63 0.52 0.00 0.00 175.17 175.19 2wvv s ILE 193 N -3.82 3.87 -0.19 4.11 -1.09 -1.26 -4.80 121.20 118.02 2wvv s ILE 193 Ca 0.04 -1.68 0.04 0.00 -2.23 0.00 0.00 60.65 56.82 2wvv s ILE 193 Cb 0.02 -3.48 -0.04 0.00 -1.58 0.00 0.00 42.46 37.38 2wvv s ILE 193 CO -0.11 -0.60 0.18 0.29 -1.23 0.00 0.00 174.94 173.47 2wvv n LYS 194 N 4.80 5.57 -4.12 2.79 5.02 -1.26 -5.02 118.16 125.95 2wvv n LYS 194 Ca -0.08 -0.02 -0.12 0.00 -2.02 0.00 0.00 58.31 56.08 2wvv n LYS 194 Cb 0.42 -0.69 -0.07 0.00 -0.02 0.00 0.00 35.03 34.66 2wvv n LYS 194 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2wvv s SER 195 N -1.35 0.31 0.15 4.39 1.04 -1.26 -5.02 113.70 111.96 2wvv s SER 195 Ca 0.02 -1.27 -0.13 0.00 0.48 0.00 0.00 55.95 55.04 2wvv s SER 195 Cb 0.03 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.69 2wvv s SER 195 CO 0.16 -1.04 1.65 0.50 0.98 0.00 0.00 173.24 175.49 2wvv h LYS 196 N 2.37 0.81 -0.61 4.02 1.63 -2.00 -2.76 116.57 120.04 2wvv h LYS 196 Ca -0.30 -0.20 -0.03 0.00 -0.85 0.00 0.00 60.65 59.27 2wvv h LYS 196 Cb 1.25 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.75 2wvv h LYS 196 CO 0.43 0.79 0.26 1.49 -3.45 0.00 0.00 179.45 178.97 2wvv h GLU 197 N 0.70 0.87 -0.50 1.90 4.81 -1.99 -1.65 114.58 118.71 2wvv h GLU 197 Ca 0.16 -0.12 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 2wvv h GLU 197 Cb 0.35 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.52 2wvv h GLU 197 CO 0.00 0.69 0.22 -0.44 -0.73 0.00 0.00 179.01 178.75 2wvv h ASP 198 N 0.86 0.27 -0.58 1.04 3.32 -1.91 0.55 116.42 119.96 2wvv h ASP 198 Ca 0.21 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 2wvv h ASP 198 Cb 0.13 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2wvv h ASP 198 CO -0.02 0.19 0.15 -1.28 -1.72 0.00 0.00 179.24 176.55 2wvv h SER 199 N 0.42 0.88 0.30 6.45 0.87 -1.12 0.99 113.55 122.35 2wvv h SER 199 Ca 0.23 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2wvv h SER 199 Cb 0.20 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2wvv h SER 199 CO -0.20 0.88 -0.17 0.40 -0.53 0.00 0.00 176.83 177.21 2wvv h ILE 200 N 0.84 0.65 -0.48 2.23 1.08 -0.87 -0.79 117.51 120.16 2wvv h ILE 200 Ca 0.18 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.65 2wvv h ILE 200 Cb 0.34 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.72 2wvv h ILE 200 CO 0.00 0.00 0.27 0.00 -0.69 0.00 0.00 178.15 177.74 2wvv h ALA 201 N 0.25 0.61 -0.07 1.87 0.00 -0.77 -2.69 119.26 118.47 2wvv h ALA 201 Ca -0.03 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 2wvv h ALA 201 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2wvv h ALA 201 CO 0.05 0.12 -0.43 0.35 0.00 0.00 0.00 179.25 179.33 2wvv h PHE 202 N 0.64 0.19 -0.74 0.00 3.57 -0.74 -0.90 116.94 118.96 2wvv h PHE 202 Ca 0.17 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2wvv h PHE 202 Cb 0.03 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 2wvv h PHE 202 CO -0.02 0.57 0.38 1.03 -2.23 0.00 0.00 178.31 178.04 2wvv h SER 203 N 0.13 0.95 -0.67 0.41 0.87 -0.89 0.10 113.55 114.44 2wvv h SER 203 Ca 0.01 -0.12 -0.06 0.00 -1.23 0.00 0.00 61.79 60.40 2wvv h SER 203 Cb 0.83 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.52 2wvv h SER 203 CO 0.06 0.79 0.19 -0.09 -0.53 0.00 0.00 176.83 177.26 2wvv h ARG 204 N 1.03 1.06 -0.89 2.24 2.43 -1.10 -2.26 114.38 116.89 2wvv h ARG 204 Ca 0.26 -0.24 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2wvv h ARG 204 Cb 0.08 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.43 2wvv h ARG 204 CO -0.04 0.93 0.59 0.35 -1.51 0.00 0.00 179.97 180.29 2wvv h PHE 205 N 0.99 1.11 -0.15 2.20 3.57 -0.63 -1.50 116.94 122.54 2wvv h PHE 205 Ca 0.21 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.64 2wvv h PHE 205 Cb 0.33 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 2wvv h PHE 205 CO 0.02 0.68 -0.37 -0.07 -2.23 0.00 0.00 178.31 176.35 2wvv h LEU 206 N 1.19 0.33 -0.44 0.59 3.38 -0.73 -0.09 115.31 119.53 2wvv h LEU 206 Ca 0.33 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2wvv h LEU 206 Cb -0.10 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2wvv h LEU 206 CO -0.08 0.67 -0.10 -0.08 0.09 0.00 0.00 178.44 178.94 2wvv h GLU 207 N 0.27 0.84 -0.65 1.13 4.81 -0.98 -0.92 114.58 119.09 2wvv h GLU 207 Ca 0.03 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 58.99 2wvv h GLU 207 Cb 0.78 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 2wvv h GLU 207 CO 0.06 0.95 0.36 0.35 -0.73 0.00 0.00 179.01 180.00 2wvv h PHE 208 N 0.68 0.66 -0.31 0.92 3.57 -1.03 -1.27 116.94 120.16 2wvv h PHE 208 Ca 0.11 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 2wvv h PHE 208 Cb 0.64 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2wvv h PHE 208 CO 0.05 0.32 0.08 1.15 -2.23 0.00 0.00 178.31 177.68 2wvv h THR 209 N 0.67 1.22 -0.76 4.41 2.02 -0.75 -2.13 112.91 117.60 2wvv h THR 209 Ca 0.29 -0.73 0.06 0.00 0.77 0.00 0.00 66.41 66.80 2wvv h THR 209 Cb 0.17 1.11 -0.06 0.00 -1.74 0.00 0.00 68.15 67.63 2wvv h THR 209 CO -0.17 0.24 0.45 0.44 0.37 0.00 0.00 175.52 176.84 2wvv h ASP 210 N 0.33 0.68 -0.21 4.18 3.32 -0.97 -0.81 116.42 122.94 2wvv h ASP 210 Ca 0.10 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.20 2wvv h ASP 210 Cb 0.29 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2wvv h ASP 210 CO 0.00 0.43 0.05 0.78 -1.72 0.00 0.00 179.24 178.79 2wvv h ASN 211 N 0.81 0.03 -0.63 6.45 2.35 -0.90 0.78 115.58 124.48 2wvv h ASN 211 Ca 0.34 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.11 2wvv h ASN 211 Cb 0.19 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.56 2wvv h ASN 211 CO -0.18 0.05 0.36 1.56 -1.65 0.00 0.00 177.43 177.57 2wvv h GLN 212 N 0.14 0.86 -0.30 0.81 4.20 -1.03 -1.43 115.11 118.36 2wvv h GLN 212 Ca 0.10 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 2wvv h GLN 212 Cb 0.08 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2wvv h GLN 212 CO -0.12 0.63 0.07 -0.07 -0.67 0.00 0.00 178.83 178.67 2wvv h LEU 213 N 0.85 0.45 -0.93 1.46 3.38 -0.81 -0.46 115.31 119.23 2wvv h LEU 213 Ca 0.22 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2wvv h LEU 213 Cb 0.01 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 2wvv h LEU 213 CO -0.04 0.56 0.62 0.11 0.09 0.00 0.00 178.44 179.78 2wvv h LYS 214 N 0.31 1.23 -0.22 1.13 1.57 -0.77 -1.27 116.57 118.54 2wvv h LYS 214 Ca 0.09 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2wvv h LYS 214 Cb 0.29 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2wvv h LYS 214 CO 0.00 0.81 0.14 1.49 -0.57 0.00 0.00 179.45 181.32 2wvv h GLU 215 N 1.26 0.30 -0.36 3.15 4.81 -1.02 -1.77 114.58 120.95 2wvv h GLU 215 Ca 0.34 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.57 2wvv h GLU 215 Cb -0.15 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 2wvv h GLU 215 CO -0.07 0.24 0.17 -0.07 -0.73 0.00 0.00 179.01 178.55 2wvv h LEU 216 N 0.28 0.25 -1.20 1.64 3.38 -0.80 -0.89 115.31 117.97 2wvv h LEU 216 Ca 0.08 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 2wvv h LEU 216 Cb 0.01 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2wvv h LEU 216 CO -0.02 0.18 -0.17 0.00 0.09 0.00 0.00 178.44 178.53 2wvv h ALA 217 N 1.20 1.34 0.07 1.53 0.00 -1.01 -2.09 119.26 120.30 2wvv h ALA 217 Ca 0.15 -0.26 -0.36 0.00 0.00 0.00 0.00 54.91 54.44 2wvv h ALA 217 Cb 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2wvv h ALA 217 CO -0.11 0.45 -2.08 0.25 0.00 0.00 0.00 179.25 177.75 2wvv n THR 218 N -4.21 1.67 0.05 0.00 -2.24 -0.69 -3.70 114.28 105.17 2wvv n THR 218 Ca -0.00 -0.67 -0.01 0.00 -2.27 0.00 0.00 64.05 61.09 2wvv n THR 218 Cb 0.32 -1.49 0.26 0.00 -2.10 0.00 0.00 70.33 67.32 2wvv n THR 218 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2wvv h ARG 219 N 0.04 0.40 -2.09 -0.78 3.08 -1.19 -3.36 114.38 110.47 2wvv h ARG 219 Ca -0.44 -0.13 -0.58 0.00 0.07 0.00 0.00 59.98 58.90 2wvv h ARG 219 Cb 2.02 -0.03 -0.40 0.00 0.08 0.00 0.00 29.97 31.63 2wvv h ARG 219 CO 0.05 0.59 -0.87 0.66 -1.07 0.00 0.00 179.97 179.33 2wvv n TYR 220 N -4.16 1.59 0.50 3.04 4.01 -0.79 -4.97 117.16 116.37 2wvv n TYR 220 Ca -0.00 -3.85 0.07 0.00 -0.16 0.00 0.00 57.90 53.95 2wvv n TYR 220 Cb 0.36 -0.45 0.30 0.00 -0.31 0.00 0.00 39.34 39.24 2wvv n TYR 220 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2wvv n PRO 221 N 1.05 0.03 0.00 -0.72 -0.04 -1.24 -1.84 135.00 132.24 2wvv n PRO 221 Ca 0.25 0.25 0.14 0.00 -0.04 0.00 0.00 63.50 64.11 2wvv n PRO 221 Cb 0.48 -1.50 0.75 0.00 -0.04 0.00 0.00 33.50 33.19 2wvv n PRO 221 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2wvv n THR 222 N -1.47 0.04 -1.63 0.52 -2.24 -1.26 -4.89 114.28 103.35 2wvv n THR 222 Ca 0.04 0.01 -0.47 0.00 -2.27 0.00 0.00 64.05 61.36 2wvv n THR 222 Cb 0.15 -0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 67.82 2wvv n THR 222 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2wvv n VAL 223 N -1.26 0.82 0.40 2.28 3.14 -0.76 -4.65 118.33 118.30 2wvv n VAL 223 Ca 0.15 -0.20 0.07 0.00 -2.96 0.00 0.00 64.34 61.39 2wvv n VAL 223 Cb 0.22 -1.19 -0.09 0.00 -1.06 0.00 0.00 33.84 31.73 2wvv n VAL 223 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2wvv n LYS 224 N 2.03 1.80 -3.60 1.45 4.76 -0.44 -4.87 118.16 119.29 2wvv n LYS 224 Ca 0.14 -0.05 -0.15 0.00 -2.87 0.00 0.00 58.31 55.38 2wvv n LYS 224 Cb 0.28 -1.20 -0.07 0.00 -1.84 0.00 0.00 35.03 32.20 2wvv n LYS 224 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wvv s ASP 225 N -2.74 -0.70 -0.22 4.39 2.15 -1.26 -1.52 116.67 116.76 2wvv s ASP 225 Ca 0.01 1.22 -0.03 0.00 0.43 0.00 0.00 52.55 54.19 2wvv s ASP 225 Cb 0.10 1.19 0.00 0.00 -0.30 0.00 0.00 42.92 43.91 2wvv s ASP 225 CO 0.56 -0.33 -0.07 -0.36 -0.17 0.00 0.00 175.17 174.80 2wvv s PHE 226 N -0.03 2.95 -0.47 -5.34 0.40 -0.45 -0.66 117.98 114.38 2wvv s PHE 226 Ca -0.02 -1.19 -0.09 0.00 -0.60 0.00 0.00 56.93 55.02 2wvv s PHE 226 Cb -0.04 -2.07 0.12 0.00 0.51 0.00 0.00 43.02 41.54 2wvv s PHE 226 CO 0.03 -0.63 0.35 -0.46 0.70 0.00 0.00 175.22 175.21 2wvv s TRP 227 N 1.42 3.42 0.35 0.36 -0.00 0.24 -2.42 118.94 122.31 2wvv s TRP 227 Ca 0.04 -1.86 -0.24 0.00 -0.00 0.00 0.00 56.10 54.05 2wvv s TRP 227 Cb -0.15 -3.51 -0.10 0.00 -0.00 0.00 0.00 33.47 29.71 2wvv s TRP 227 CO -0.05 -1.00 0.92 -0.06 -0.00 0.00 0.00 176.95 176.76 2wvv s PHE 228 N 1.37 3.56 0.24 5.86 0.08 -1.26 -1.25 117.98 126.59 2wvv s PHE 228 Ca 0.06 1.68 0.01 0.00 0.12 0.00 0.00 56.93 58.79 2wvv s PHE 228 Cb -0.26 -2.86 -0.04 0.00 -0.57 0.00 0.00 43.02 39.28 2wvv s PHE 228 CO -0.01 0.12 0.13 0.34 -0.10 0.00 0.00 175.22 175.71 2wvv s ASP 229 N -1.81 0.79 -1.30 1.36 2.15 -0.53 -4.41 116.67 112.92 2wvv s ASP 229 Ca 0.53 -1.43 -0.06 0.00 0.43 0.00 0.00 52.55 52.02 2wvv s ASP 229 Cb -0.15 0.32 0.01 0.00 -0.30 0.00 0.00 42.92 42.79 2wvv s ASP 229 CO 0.20 -0.82 1.11 0.61 -0.17 0.00 0.00 175.17 176.10 2wvv n GLY 230 N -0.40 -0.48 0.14 2.66 0.00 -1.26 -1.29 105.19 104.56 2wvv n GLY 230 Ca 0.01 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.27 2wvv n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wvv n THR 231 N -4.68 1.34 0.65 2.61 -2.24 -1.26 -1.79 114.28 108.92 2wvv n THR 231 Ca -0.10 -1.43 0.13 0.00 -2.27 0.00 0.00 64.05 60.37 2wvv n THR 231 Cb 0.60 0.23 0.33 0.00 -2.10 0.00 0.00 70.33 69.39 2wvv n THR 231 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2wvv n TRP 232 N -0.68 0.68 -1.91 4.78 2.14 -1.26 -4.56 117.44 116.63 2wvv n TRP 232 Ca 0.07 0.20 -0.34 0.00 2.07 0.00 0.00 57.50 59.50 2wvv n TRP 232 Cb 0.42 -0.77 0.04 0.00 -0.81 0.00 0.00 31.31 30.19 2wvv n TRP 232 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2wvv s ASP 233 N -4.23 5.16 0.48 -0.67 1.01 -1.26 -4.81 116.67 112.36 2wvv s ASP 233 Ca 0.09 2.19 0.21 0.00 0.71 0.00 0.00 52.55 55.75 2wvv s ASP 233 Cb 0.13 -2.58 1.24 0.00 1.01 0.00 0.00 42.92 42.73 2wvv s ASP 233 CO 0.64 -1.60 1.96 0.00 0.21 0.00 0.00 175.17 176.38 2wvv h ALA 234 N 0.50 2.32 -0.70 5.23 0.00 -1.81 -1.30 119.26 123.51 2wvv h ALA 234 Ca -0.49 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 2wvv h ALA 234 Cb 1.27 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2wvv h ALA 234 CO 0.54 -0.50 0.36 0.66 0.00 0.00 0.00 179.25 180.32 2wvv h SER 235 N 0.19 0.89 -0.05 0.00 4.64 -1.66 -0.18 113.55 117.38 2wvv h SER 235 Ca 0.31 -0.11 -0.20 0.00 -0.47 0.00 0.00 61.79 61.31 2wvv h SER 235 Cb 0.93 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2wvv h SER 235 CO -0.05 0.75 -0.72 0.58 -0.87 0.00 0.00 176.83 176.51 2wvv h VAL 236 N 0.97 1.30 -0.55 0.95 2.07 -1.56 -3.07 116.25 116.36 2wvv h VAL 236 Ca 0.24 -1.97 -0.00 0.00 0.82 0.00 0.00 66.70 65.79 2wvv h VAL 236 Cb 0.07 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.77 2wvv h VAL 236 CO -0.04 0.62 0.34 0.11 0.02 0.00 0.00 177.57 178.62 2wvv h LYS 237 N 0.48 0.74 0.00 1.57 1.57 -1.04 -0.45 116.57 119.45 2wvv h LYS 237 Ca -0.04 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2wvv h LYS 237 Cb 1.33 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2wvv h LYS 237 CO 0.14 0.51 0.00 1.63 -0.57 0.00 0.00 179.45 181.17 2wvv n LYS 238 N -4.43 0.02 -2.33 3.15 5.02 -0.11 -3.65 118.16 115.83 2wvv n LYS 238 Ca 0.05 0.09 -0.26 0.00 -2.02 0.00 0.00 58.31 56.18 2wvv n LYS 238 Cb 0.07 -1.52 0.01 0.00 -0.02 0.00 0.00 35.03 33.56 2wvv n LYS 238 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wvv n ASN 239 N -1.55 4.73 -0.34 4.39 4.13 -0.18 -4.86 115.26 121.58 2wvv n ASN 239 Ca 0.06 -3.71 0.14 0.00 1.68 0.00 0.00 54.58 52.75 2wvv n ASN 239 Cb 0.29 -0.42 0.34 0.00 -1.54 0.00 0.00 39.78 38.45 2wvv n ASN 239 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2wvv h GLY 240 N 2.45 1.70 -0.16 7.41 0.00 -1.62 -0.81 103.07 112.05 2wvv h GLY 240 Ca 0.32 -0.35 0.24 0.00 0.00 0.00 0.00 47.33 47.54 2wvv h GLY 240 CO 0.81 -0.06 0.55 0.11 0.00 0.00 0.00 176.54 177.95 2wvv h TRP 241 N 0.73 0.93 -0.37 5.60 5.08 -1.84 -1.60 115.95 124.49 2wvv h TRP 241 Ca 0.57 0.04 -0.16 0.00 1.08 0.00 0.00 58.89 60.42 2wvv h TRP 241 Cb 0.93 -0.26 -0.01 0.00 -3.00 0.00 0.00 29.16 26.83 2wvv h TRP 241 CO -0.00 0.04 -0.39 2.35 -1.28 0.00 0.00 178.44 179.15 2wvv h TRP 242 N 0.54 1.07 -0.86 0.12 7.01 -1.52 -0.87 115.95 121.44 2wvv h TRP 242 Ca 0.63 -0.32 -0.02 0.00 2.11 0.00 0.00 58.89 61.29 2wvv h TRP 242 Cb 1.19 -0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 27.99 2wvv h TRP 242 CO -0.03 1.13 0.48 1.79 -2.79 0.00 0.00 178.44 179.02 2wvv h THR 243 N 0.73 1.25 -0.36 2.65 1.35 -1.27 0.27 112.91 117.53 2wvv h THR 243 Ca 0.06 -0.61 -0.10 0.00 -0.55 0.00 0.00 66.41 65.21 2wvv h THR 243 Cb 0.98 0.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.47 2wvv h THR 243 CO 0.09 0.28 -0.16 0.00 -0.25 0.00 0.00 175.52 175.48 2wvv h ALA 244 N 1.26 0.50 -0.57 6.62 0.00 -1.24 -2.16 119.26 123.67 2wvv h ALA 244 Ca 0.30 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2wvv h ALA 244 Cb 0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2wvv h ALA 244 CO -0.05 0.41 0.30 1.25 0.00 0.00 0.00 179.25 181.17 2wvv h HIS 245 N 0.52 0.56 -0.55 0.00 -0.00 -0.76 -2.09 115.15 112.83 2wvv h HIS 245 Ca 0.08 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.44 2wvv h HIS 245 Cb 0.70 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 27.91 2wvv h HIS 245 CO 0.06 0.28 0.20 0.00 -0.00 0.00 0.00 177.93 178.47 2wvv h ALA 246 N 1.29 0.71 -0.26 5.26 0.00 -0.33 0.35 119.26 126.29 2wvv h ALA 246 Ca 0.25 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2wvv h ALA 246 Cb 0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2wvv h ALA 246 CO -0.16 0.34 0.06 1.49 0.00 0.00 0.00 179.25 180.99 2wvv h GLU 247 N 0.75 0.16 -0.40 0.00 4.81 -1.22 -1.96 114.58 116.72 2wvv h GLU 247 Ca 0.18 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.31 2wvv h GLU 247 Cb 0.23 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2wvv h GLU 247 CO -0.01 0.11 -0.09 0.37 -0.73 0.00 0.00 179.01 178.66 2wvv h GLN 248 N 0.17 0.76 -0.39 1.92 5.75 -1.11 -1.54 115.11 120.68 2wvv h GLN 248 Ca 0.12 -0.29 0.07 0.00 -0.15 0.00 0.00 58.65 58.40 2wvv h GLN 248 Cb 0.11 -0.05 -0.06 0.00 1.07 0.00 0.00 27.48 28.56 2wvv h GLN 248 CO -0.14 0.89 0.04 1.98 -2.65 0.00 0.00 178.83 178.94 2wvv h MET 249 N 0.57 0.14 -0.33 1.69 4.05 -0.85 -0.96 114.93 119.25 2wvv h MET 249 Ca 0.10 -0.01 -0.14 0.00 -0.28 0.00 0.00 59.70 59.37 2wvv h MET 249 Cb 0.60 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.36 2wvv h MET 249 CO 0.04 0.09 -0.36 -0.07 0.23 0.00 0.00 176.91 176.84 2wvv h LEU 250 N 0.15 0.80 -1.48 3.39 3.38 -1.28 -2.66 115.31 117.61 2wvv h LEU 250 Ca 0.19 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2wvv h LEU 250 Cb 0.25 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2wvv h LEU 250 CO -0.28 1.08 -0.27 0.11 0.09 0.00 0.00 178.44 179.17 2wvv h LYS 251 N 0.63 0.00 0.00 1.13 1.57 -0.83 0.14 116.57 119.20 2wvv h LYS 251 Ca 0.06 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.72 2wvv h LYS 251 Cb 0.90 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.20 2wvv h LYS 251 CO 0.08 0.27 -0.55 0.93 -0.57 0.00 0.00 179.45 179.61 2wvv h GLU 252 N 0.00 0.00 0.00 3.15 5.08 -1.02 -3.31 114.58 118.48 2wvv h GLU 252 Ca -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2wvv h GLU 252 Cb 0.50 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2wvv h GLU 252 CO 0.03 0.55 -1.42 1.28 -1.00 0.00 0.00 179.01 178.46 2wvv n LEU 253 N -3.43 0.86 -3.76 1.33 4.77 -0.84 -4.71 117.00 111.22 2wvv n LEU 253 Ca 0.00 0.38 -0.30 0.00 -0.03 0.00 0.00 56.01 56.06 2wvv n LEU 253 Cb 0.67 0.07 -0.15 0.00 -2.33 0.00 0.00 43.42 41.69 2wvv n LEU 253 CO 0.40 0.15 -0.33 -0.69 -1.33 0.00 0.00 177.39 175.59 2wvv s VAL 254 N -2.92 1.03 -0.02 4.08 1.01 -0.02 -4.92 120.40 118.63 2wvv s VAL 254 Ca -0.03 -1.51 -0.36 0.00 0.00 0.00 0.00 61.98 60.08 2wvv s VAL 254 Cb 0.09 -1.78 -0.14 0.00 0.00 0.00 0.00 36.38 34.55 2wvv s VAL 254 CO 0.81 -0.67 1.67 -2.65 0.00 0.00 0.00 175.10 174.26 2wvv n PRO 255 N 4.77 1.80 -0.98 2.72 -0.02 -1.26 -1.77 135.00 140.25 2wvv n PRO 255 Ca -0.01 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2wvv n PRO 255 Cb 0.42 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2wvv n PRO 255 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wvv n GLY 256 N 3.74 0.85 3.71 -1.23 0.00 -1.26 -5.00 105.19 106.00 2wvv n GLY 256 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 2wvv n GLY 256 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wvv n VAL 257 N -2.22 3.73 -3.90 1.61 3.14 -0.73 -4.61 118.33 115.34 2wvv n VAL 257 Ca 0.00 -0.50 -0.32 0.00 -2.96 0.00 0.00 64.34 60.56 2wvv n VAL 257 Cb 0.00 -1.52 -0.04 0.00 -1.06 0.00 0.00 33.84 31.22 2wvv n VAL 257 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2wvv s ALA 258 N -1.33 3.98 -0.04 1.55 0.00 -0.58 -4.94 121.76 120.41 2wvv s ALA 258 Ca 0.72 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.90 2wvv s ALA 258 Cb -0.43 -1.87 0.02 0.00 0.00 0.00 0.00 23.12 20.84 2wvv s ALA 258 CO 0.49 0.79 -0.06 0.42 0.00 0.00 0.00 175.76 177.41 2wvv s ILE 259 N -1.44 0.59 0.62 0.00 -1.09 -1.26 -1.34 121.20 117.28 2wvv s ILE 259 Ca 0.32 -0.19 -0.11 0.00 -2.23 0.00 0.00 60.65 58.44 2wvv s ILE 259 Cb -0.13 -0.58 -0.04 0.00 -1.58 0.00 0.00 42.46 40.13 2wvv s ILE 259 CO 0.24 0.22 1.03 0.54 -1.23 0.00 0.00 174.94 175.74 2wvv s ASN 260 N 0.66 6.20 0.50 3.58 4.22 -1.02 -0.66 114.94 128.43 2wvv s ASN 260 Ca -0.09 1.43 0.25 0.00 -2.14 0.00 0.00 52.86 52.31 2wvv s ASN 260 Cb -0.12 -2.47 1.35 0.00 1.28 0.00 0.00 41.25 41.28 2wvv s ASN 260 CO 0.00 -0.89 2.05 0.77 -2.04 0.00 0.00 177.10 176.99 2wvv h SER 261 N -0.32 0.00 0.02 3.54 4.64 -1.28 -3.13 113.55 117.02 2wvv h SER 261 Ca -0.44 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2wvv h SER 261 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2wvv h SER 261 CO 0.62 0.14 -0.01 -0.09 -0.87 0.00 0.00 176.83 176.61 2wvv h ARG 262 N 0.00 0.00 -0.80 4.77 2.43 -1.84 -1.02 114.38 117.92 2wvv h ARG 262 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2wvv h ARG 262 Cb 0.35 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 2wvv h ARG 262 CO 0.02 0.01 0.51 1.25 -1.51 0.00 0.00 179.97 180.26 2wvv h LEU 263 N 0.00 0.93 -9.50 3.80 5.85 -1.75 -3.44 115.31 111.20 2wvv h LEU 263 Ca -0.00 -0.03 -0.61 0.00 0.84 0.00 0.00 57.88 58.08 2wvv h LEU 263 Cb 0.03 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 40.75 2wvv h LEU 263 CO 0.00 0.69 -0.27 -0.13 -0.34 0.00 0.00 178.44 178.39 2wvv s ARG 264 N -5.87 4.03 0.03 1.25 1.81 -0.39 -4.84 118.95 114.97 2wvv s ARG 264 Ca -0.11 0.24 0.04 0.00 -1.72 0.00 0.00 55.73 54.18 2wvv s ARG 264 Cb 0.18 -3.31 -0.02 0.00 -0.45 0.00 0.00 34.95 31.34 2wvv s ARG 264 CO 0.79 0.48 -0.13 0.00 -0.68 0.00 0.00 175.30 175.76 2wvv s ALA 265 N -0.32 1.07 0.55 2.13 0.00 -1.26 -1.90 121.76 122.03 2wvv s ALA 265 Ca 0.20 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.40 2wvv s ALA 265 Cb -0.15 -0.17 0.03 0.00 0.00 0.00 0.00 23.12 22.83 2wvv s ALA 265 CO 0.08 0.20 0.19 -0.40 0.00 0.00 0.00 175.76 175.83 2wvv n ASP 266 N 2.02 0.20 0.18 0.00 5.75 -0.38 -4.40 116.55 119.90 2wvv n ASP 266 Ca -0.18 -1.18 0.18 0.00 -0.01 0.00 0.00 54.79 53.61 2wvv n ASP 266 Cb 0.55 -0.13 0.81 0.00 -1.03 0.00 0.00 41.12 41.32 2wvv n ASP 266 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2wvv h ASP 267 N -0.14 0.00 -0.04 -1.12 3.45 -1.91 -2.02 116.42 114.64 2wvv h ASP 267 Ca -0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.40 2wvv h ASP 267 Cb 0.21 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.98 2wvv h ASP 267 CO 0.06 0.00 0.00 0.29 -1.57 0.00 0.00 179.24 178.02 2wvv n LYS 268 N -3.74 1.72 -0.48 3.56 4.76 -1.26 -4.91 118.16 117.81 2wvv n LYS 268 Ca 0.03 -1.67 0.00 0.00 -2.87 0.00 0.00 58.31 53.80 2wvv n LYS 268 Cb 0.42 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.23 2wvv n LYS 268 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wvv n GLY 269 N 1.09 0.76 3.73 0.72 0.00 -0.76 -5.03 105.19 105.70 2wvv n GLY 269 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2wvv n GLY 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvv s LYS 270 N -0.52 4.60 0.14 1.61 3.01 -1.26 -4.74 119.74 122.58 2wvv s LYS 270 Ca 0.00 1.29 0.05 0.00 -1.01 0.00 0.00 55.97 56.30 2wvv s LYS 270 Cb 0.00 -3.39 -0.04 0.00 -1.01 0.00 0.00 37.83 33.39 2wvv s LYS 270 CO 0.00 0.19 0.10 1.03 0.51 0.00 0.00 175.35 177.17 2wvv s ARG 271 N 0.17 2.81 0.00 1.68 0.52 -1.26 -1.25 118.95 121.62 2wvv s ARG 271 Ca 0.44 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.80 2wvv s ARG 271 Cb -0.22 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 32.63 2wvv s ARG 271 CO 0.27 0.50 0.00 0.72 0.02 0.00 0.00 175.30 176.81 2wvv n HIS 272 N -0.06 0.00 -4.81 -0.53 8.25 -0.80 -4.70 115.22 112.57 2wvv n HIS 272 Ca -0.09 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 2wvv n HIS 272 Cb 0.54 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.52 2wvv n HIS 272 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wvv s PHE 273 N 0.00 2.77 0.43 4.41 0.40 -1.26 -0.76 117.98 123.97 2wvv s PHE 273 Ca 0.00 -0.13 -0.07 0.00 -0.60 0.00 0.00 56.93 56.13 2wvv s PHE 273 Cb 0.00 -1.66 0.10 0.00 0.51 0.00 0.00 43.02 41.97 2wvv s PHE 273 CO 0.00 0.21 0.50 -0.40 0.70 0.00 0.00 175.22 176.23 2wvv n ASP 274 N 2.35 -0.53 0.13 1.36 5.68 0.48 -4.81 116.55 121.21 2wvv n ASP 274 Ca -0.17 -1.03 0.12 0.00 -0.50 0.00 0.00 54.79 53.20 2wvv n ASP 274 Cb 0.52 -0.41 0.49 0.00 -1.14 0.00 0.00 41.12 40.59 2wvv n ASP 274 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2wvv n SER 275 N -3.50 0.64 -1.47 -1.12 7.64 -1.26 -1.26 113.62 113.29 2wvv n SER 275 Ca 0.06 0.67 0.11 0.00 1.01 0.00 0.00 58.87 60.72 2wvv n SER 275 Cb 0.23 -0.80 0.34 0.00 -1.01 0.00 0.00 64.21 62.98 2wvv n SER 275 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2wvv n ASN 276 N -2.22 4.34 -0.16 6.43 3.02 -1.26 -4.82 115.26 120.59 2wvv n ASN 276 Ca 0.02 -2.19 -0.02 0.00 -0.03 0.00 0.00 54.58 52.36 2wvv n ASN 276 Cb 0.22 -0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 38.84 2wvv n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wvv n GLY 277 N 1.46 0.55 3.78 7.41 0.00 -0.39 -5.03 105.19 112.98 2wvv n GLY 277 Ca 0.25 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 2wvv n GLY 277 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvv s ARG 278 N -1.46 4.01 0.14 1.61 0.52 -1.26 -4.75 118.95 117.77 2wvv s ARG 278 Ca 0.00 0.12 -0.31 0.00 -0.52 0.00 0.00 55.73 55.02 2wvv s ARG 278 Cb 0.00 -3.33 -0.09 0.00 0.52 0.00 0.00 34.95 32.04 2wvv s ARG 278 CO 0.00 0.45 1.58 -1.17 0.02 0.00 0.00 175.30 176.18 2wvv s LEU 279 N -0.19 4.37 0.24 2.53 2.96 -1.26 -0.38 118.68 126.94 2wvv s LEU 279 Ca 0.18 2.56 -0.02 0.00 -0.22 0.00 0.00 54.13 56.63 2wvv s LEU 279 Cb -0.14 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 2wvv s LEU 279 CO 0.06 -0.83 0.46 -0.04 -1.32 0.00 0.00 176.35 174.68 2wvv s MET 280 N 1.52 3.55 1.73 1.98 -1.94 0.06 -4.59 119.30 121.61 2wvv s MET 280 Ca 0.71 -0.23 0.00 0.00 -1.71 0.00 0.00 55.69 54.46 2wvv s MET 280 Cb -0.42 -2.76 0.00 0.00 2.01 0.00 0.00 34.83 33.66 2wvv s MET 280 CO 0.31 0.32 0.00 0.41 -0.01 0.00 0.00 175.02 176.05 2wvv n GLY 281 N -0.86 -1.27 0.01 -0.03 0.00 -1.26 -4.07 105.19 97.70 2wvv n GLY 281 Ca -0.04 -1.21 0.10 0.00 0.00 0.00 0.00 46.02 44.87 2wvv n GLY 281 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wvv n ASP 282 N -0.75 0.58 -3.52 1.61 8.00 0.17 -4.78 116.55 117.87 2wvv n ASP 282 Ca 0.00 -0.31 -0.17 0.00 0.71 0.00 0.00 54.79 55.02 2wvv n ASP 282 Cb 0.00 1.62 -0.06 0.00 -0.02 0.00 0.00 41.12 42.66 2wvv n ASP 282 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2wvv s TYR 283 N -3.21 -0.63 0.19 1.24 -0.85 -1.25 -4.57 117.35 108.27 2wvv s TYR 283 Ca -0.03 1.05 -0.30 0.00 -0.52 0.00 0.00 57.07 57.27 2wvv s TYR 283 Cb 0.13 0.42 -0.08 0.00 0.38 0.00 0.00 41.96 42.82 2wvv s TYR 283 CO 0.82 -0.59 0.99 -2.00 -1.52 0.00 0.00 175.55 173.25 2wvv s GLU 284 N -1.28 4.74 -0.30 -3.49 -6.30 0.00 -1.15 118.70 110.92 2wvv s GLU 284 Ca -0.10 1.54 0.19 0.00 -2.50 0.00 0.00 54.97 54.11 2wvv s GLU 284 Cb -0.00 -3.31 0.47 0.00 0.00 0.00 0.00 34.13 31.30 2wvv s GLU 284 CO 0.08 0.31 1.00 -1.13 0.02 0.00 0.00 175.26 175.55 2wvv n SER 285 N 2.07 1.42 -0.14 -1.70 3.41 -1.26 -1.17 113.62 116.24 2wvv n SER 285 Ca 0.00 -2.50 0.04 0.00 -0.26 0.00 0.00 58.87 56.15 2wvv n SER 285 Cb 0.47 -0.49 -0.01 0.00 -0.26 0.00 0.00 64.21 63.92 2wvv n SER 285 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wvv n GLY 286 N -0.23 -0.07 3.48 5.00 0.00 -1.26 -4.70 105.19 107.40 2wvv n GLY 286 Ca 0.08 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2wvv n GLY 286 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvv s TYR 287 N -1.36 2.83 -0.23 1.61 1.51 -1.26 -4.95 117.35 115.50 2wvv s TYR 287 Ca 0.06 -0.98 0.02 0.00 -1.01 0.00 0.00 57.07 55.17 2wvv s TYR 287 Cb 0.07 -4.39 0.05 0.00 -0.11 0.00 0.00 41.96 37.58 2wvv s TYR 287 CO 0.24 -1.65 -0.14 -2.00 -1.11 0.00 0.00 175.55 170.89 2wvv s GLU 288 N 3.69 2.52 -1.72 -0.62 2.12 -1.26 -1.81 118.70 121.61 2wvv s GLU 288 Ca 0.32 -1.16 0.00 0.00 0.36 0.00 0.00 54.97 54.50 2wvv s GLU 288 Cb -0.07 -2.78 0.00 0.00 0.26 0.00 0.00 34.13 31.54 2wvv s GLU 288 CO -0.03 -0.44 0.00 0.54 -0.54 0.00 0.00 175.26 174.79 2wvv n ARG 289 N 4.50 -1.69 -3.51 4.30 1.74 -0.63 -4.79 116.66 116.57 2wvv n ARG 289 Ca -0.17 0.97 -0.10 0.00 -0.77 0.00 0.00 57.85 57.78 2wvv n ARG 289 Cb 0.45 -5.52 -0.02 0.00 -1.02 0.00 0.00 32.46 26.35 2wvv n ARG 289 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2wvv s ARG 290 N -4.55 1.32 0.10 5.56 1.70 -1.26 -5.07 118.95 116.75 2wvv s ARG 290 Ca 0.00 -0.55 0.03 0.00 -0.47 0.00 0.00 55.73 54.74 2wvv s ARG 290 Cb 0.00 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.91 2wvv s ARG 290 CO 0.00 -0.58 -0.08 -0.51 -1.08 0.00 0.00 175.30 173.05 2wvv s LEU 291 N -2.76 2.47 0.59 -1.89 1.43 -1.26 -4.71 118.68 112.55 2wvv s LEU 291 Ca 0.03 -0.92 -0.18 0.00 -1.03 0.00 0.00 54.13 52.04 2wvv s LEU 291 Cb -0.02 -0.18 -0.03 0.00 0.03 0.00 0.00 46.19 45.98 2wvv s LEU 291 CO -0.09 -0.37 1.13 -2.16 0.23 0.00 0.00 176.35 175.10 2wvv s PRO 292 N -3.36 3.10 0.04 1.29 0.04 -1.26 -4.97 135.00 129.88 2wvv s PRO 292 Ca 0.09 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.40 2wvv s PRO 292 Cb 0.01 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2wvv s PRO 292 CO -0.02 -1.05 1.20 0.34 0.04 0.00 0.00 177.00 177.51 2wvv s ASP 293 N -2.02 7.08 0.31 6.66 2.15 -1.26 -4.91 116.67 124.68 2wvv s ASP 293 Ca 0.71 1.98 0.23 0.00 0.43 0.00 0.00 52.55 55.90 2wvv s ASP 293 Cb -0.24 -2.57 1.13 0.00 -0.30 0.00 0.00 42.92 40.94 2wvv s ASP 293 CO 0.33 -0.49 1.71 -0.65 -0.17 0.00 0.00 175.17 175.90 2wvv h PRO 294 N 6.93 0.00 0.00 4.34 0.11 -1.93 -0.82 132.00 140.63 2wvv h PRO 294 Ca -0.40 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.41 2wvv h PRO 294 Cb 1.21 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.26 2wvv h PRO 294 CO 0.82 0.00 -2.09 0.28 -0.21 0.00 0.00 178.00 176.80 2wvv n VAL 295 N -2.30 1.09 0.03 3.15 0.31 -1.26 -4.73 118.33 114.62 2wvv n VAL 295 Ca 0.00 -0.38 0.11 0.00 -0.01 0.00 0.00 64.34 64.06 2wvv n VAL 295 Cb 0.12 -1.34 -0.11 0.00 -0.91 0.00 0.00 33.84 31.60 2wvv n VAL 295 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wvv n LYS 296 N -3.29 0.64 -1.47 5.55 5.02 -1.16 -4.47 118.16 118.98 2wvv n LYS 296 Ca -0.35 -0.09 -0.21 0.00 -2.02 0.00 0.00 58.31 55.63 2wvv n LYS 296 Cb 0.84 -1.62 0.09 0.00 -0.02 0.00 0.00 35.03 34.32 2wvv n LYS 296 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wvv n ASP 297 N -2.40 4.92 0.05 4.39 8.00 -0.32 -4.74 116.55 126.45 2wvv n ASP 297 Ca -0.03 -3.77 0.06 0.00 0.71 0.00 0.00 54.79 51.75 2wvv n ASP 297 Cb 0.57 -0.61 0.26 0.00 -0.02 0.00 0.00 41.12 41.32 2wvv n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wvv n LEU 298 N -0.90 0.21 -0.11 0.64 4.77 -1.26 -2.29 117.00 118.06 2wvv n LEU 298 Ca 0.46 0.58 0.26 0.00 -0.03 0.00 0.00 56.01 57.28 2wvv n LEU 298 Cb 0.92 -0.58 0.72 0.00 -2.33 0.00 0.00 43.42 42.14 2wvv n LEU 298 CO 0.45 -0.55 1.24 0.07 -1.33 0.00 0.00 177.39 177.26 2wvv h LYS 299 N 0.00 0.00 0.00 3.23 2.10 -1.96 -1.90 116.57 118.04 2wvv h LYS 299 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2wvv h LYS 299 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 2wvv h LYS 299 CO 0.00 0.00 0.00 -0.39 -2.00 0.00 0.00 179.45 177.06 2wvv h VAL 300 N 0.00 0.00 0.00 0.07 -1.51 -1.80 -2.05 116.25 110.96 2wvv h VAL 300 Ca 0.36 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 65.54 2wvv h VAL 300 Cb 1.50 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.73 2wvv h VAL 300 CO -0.00 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.69 2wvv n THR 301 N -2.40 0.80 0.48 7.19 -2.24 -0.72 -2.82 114.28 114.56 2wvv n THR 301 Ca 0.02 0.16 0.13 0.00 -2.27 0.00 0.00 64.05 62.09 2wvv n THR 301 Cb 0.25 -1.07 0.42 0.00 -2.10 0.00 0.00 70.33 67.82 2wvv n THR 301 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2wvv h GLN 302 N 0.00 0.00 -4.55 -0.78 4.20 -1.57 -3.46 115.11 108.95 2wvv h GLN 302 Ca 0.00 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 2wvv h GLN 302 Cb 0.41 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.04 2wvv h GLN 302 CO 0.00 0.00 -0.68 1.67 -0.67 0.00 0.00 178.83 179.15 2wvv s TRP 303 N -3.22 0.84 0.42 2.96 -2.14 -1.13 -4.59 118.94 112.08 2wvv s TRP 303 Ca 0.08 -1.00 -0.25 0.00 2.66 0.00 0.00 56.10 57.59 2wvv s TRP 303 Cb 0.10 -0.51 -0.08 0.00 -3.10 0.00 0.00 33.47 29.88 2wvv s TRP 303 CO 0.55 -0.25 1.17 -0.51 -2.66 0.00 0.00 176.95 175.25 2wvv s ASP 304 N -3.03 6.42 0.11 -2.66 1.01 -1.26 -4.94 116.67 112.31 2wvv s ASP 304 Ca 0.14 2.34 -0.17 0.00 0.71 0.00 0.00 52.55 55.57 2wvv s ASP 304 Cb 0.06 -2.61 0.04 0.00 1.01 0.00 0.00 42.92 41.42 2wvv s ASP 304 CO -0.04 -0.75 0.42 -1.66 0.21 0.00 0.00 175.17 173.35 2wvv s TRP 305 N -1.45 -0.25 -0.03 4.23 1.48 -1.26 -0.82 118.94 120.84 2wvv s TRP 305 Ca 0.59 0.00 -0.01 0.00 -1.06 0.00 0.00 56.10 55.62 2wvv s TRP 305 Cb -0.30 0.28 0.03 0.00 -1.16 0.00 0.00 33.47 32.32 2wvv s TRP 305 CO 0.38 -0.69 0.04 -2.00 -4.06 0.00 0.00 176.95 170.61 2wvv s GLU 306 N -3.52 0.02 0.21 3.25 2.12 -0.31 -1.22 118.70 119.25 2wvv s GLU 306 Ca 0.01 0.24 -0.00 0.00 0.36 0.00 0.00 54.97 55.57 2wvv s GLU 306 Cb 0.01 -0.41 -0.04 0.00 0.26 0.00 0.00 34.13 33.95 2wvv s GLU 306 CO -0.10 -0.23 0.39 0.00 -0.54 0.00 0.00 175.26 174.79 2wvv s ALA 307 N 1.49 3.83 0.15 6.30 0.00 0.08 -4.49 121.76 129.13 2wvv s ALA 307 Ca -0.04 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.13 2wvv s ALA 307 Cb -0.13 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 2wvv s ALA 307 CO -0.03 0.41 -0.13 0.00 0.00 0.00 0.00 175.76 176.01 2wvv s MET 309 N -3.32 0.84 0.21 0.00 0.23 -0.63 -1.60 119.30 115.02 2wvv s MET 309 Ca 0.15 -0.38 0.05 0.00 -1.03 0.00 0.00 55.69 54.49 2wvv s MET 309 Cb -0.01 0.37 -0.03 0.00 -1.53 0.00 0.00 34.83 33.62 2wvv s MET 309 CO 0.03 -0.27 0.25 0.95 -2.03 0.00 0.00 175.02 173.95 2wvv s THR 310 N -2.30 4.86 -0.07 3.16 -4.23 -1.26 -1.22 115.64 114.59 2wvv s THR 310 Ca -0.07 -1.08 -0.18 0.00 -1.18 0.00 0.00 61.69 59.18 2wvv s THR 310 Cb -0.01 -3.58 -0.14 0.00 1.34 0.00 0.00 72.50 70.10 2wvv s THR 310 CO -0.01 -0.25 0.69 0.40 -0.54 0.00 0.00 174.62 174.91 2wvv h ILE 311 N 1.53 0.80 -3.50 2.99 2.04 -1.83 -3.46 117.51 116.08 2wvv h ILE 311 Ca -0.49 -1.27 -0.41 0.00 1.00 0.00 0.00 64.86 63.69 2wvv h ILE 311 Cb 1.22 1.40 0.19 0.00 -0.74 0.00 0.00 36.82 38.89 2wvv h ILE 311 CO 0.63 0.23 0.20 -0.81 0.00 0.00 0.00 178.15 178.39 2wvv n PRO 312 N -4.86 -2.67 -0.10 2.37 -0.05 -1.26 -1.60 135.00 126.82 2wvv n PRO 312 Ca -0.07 -1.84 -0.08 0.00 -0.05 0.00 0.00 63.50 61.46 2wvv n PRO 312 Cb 0.25 -1.57 -0.01 0.00 -0.05 0.00 0.00 33.50 32.12 2wvv n PRO 312 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 175.50 176.94 2wvv h GLU 313 N 0.00 0.43 -0.15 0.54 4.22 -1.80 -3.40 114.58 114.42 2wvv h GLU 313 Ca -0.42 -0.03 -0.21 0.00 0.08 0.00 0.00 59.36 58.78 2wvv h GLU 313 Cb 1.24 -0.10 -0.14 0.00 0.50 0.00 0.00 28.75 30.25 2wvv h GLU 313 CO 0.28 0.28 -0.49 -1.71 -2.18 0.00 0.00 179.01 175.19 2wvv n ASN 314 N -4.87 -2.98 -3.80 1.04 5.15 -1.26 -4.86 115.26 103.68 2wvv n ASN 314 Ca -0.01 -3.25 -0.22 0.00 -0.60 0.00 0.00 54.58 50.50 2wvv n ASN 314 Cb 0.03 1.82 -0.17 0.00 -0.53 0.00 0.00 39.78 40.93 2wvv n ASN 314 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2wvv s GLN 315 N 0.72 0.68 -0.14 1.20 -1.52 -1.26 -3.89 119.66 115.45 2wvv s GLN 315 Ca 0.32 0.05 -0.13 0.00 -1.95 0.00 0.00 55.36 53.65 2wvv s GLN 315 Cb 0.20 -0.95 -0.06 0.00 -0.22 0.00 0.00 33.01 31.98 2wvv s GLN 315 CO -0.22 -0.25 -0.27 0.91 -0.25 0.00 0.00 175.29 175.21 2wvv n TRP 316 N 4.86 0.00 -1.40 0.91 7.02 -1.26 -4.66 117.44 122.92 2wvv n TRP 316 Ca -0.12 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.07 2wvv n TRP 316 Cb 0.50 -0.48 0.13 0.00 -2.42 0.00 0.00 31.31 29.04 2wvv n TRP 316 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2wvv s GLY 317 N -4.88 1.60 -0.04 6.99 0.00 -1.26 -3.74 107.32 105.98 2wvv s GLY 317 Ca -0.24 -0.29 -0.33 0.00 0.00 0.00 0.00 44.72 43.86 2wvv s GLY 317 CO 0.34 0.22 1.87 2.98 0.00 0.00 0.00 173.10 178.51 2wvv n TYR 318 N -3.77 2.37 -4.98 1.90 9.36 -1.26 -4.60 117.16 116.18 2wvv n TYR 318 Ca 0.07 -0.05 -0.32 0.00 3.32 0.00 0.00 57.90 60.91 2wvv n TYR 318 Cb 0.57 -2.68 -0.16 0.00 -0.63 0.00 0.00 39.34 36.44 2wvv n TYR 318 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2wvv s HIS 319 N 3.81 2.70 -0.17 2.98 5.65 -1.26 -4.24 115.29 124.76 2wvv s HIS 319 Ca 0.90 -0.83 0.29 0.00 0.25 0.00 0.00 55.06 55.68 2wvv s HIS 319 Cb -0.64 -1.78 1.19 0.00 -1.18 0.00 0.00 32.58 30.17 2wvv s HIS 319 CO 0.48 -0.31 1.86 1.57 -0.65 0.00 0.00 174.74 177.70 2wvv h LYS 320 N 6.70 0.00 -3.17 2.88 2.10 -1.39 -3.39 116.57 120.30 2wvv h LYS 320 Ca -0.23 0.00 -0.62 0.00 -2.00 0.00 0.00 60.65 57.80 2wvv h LYS 320 Cb 1.23 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 32.15 2wvv h LYS 320 CO 0.52 0.00 -0.69 0.34 -2.00 0.00 0.00 179.45 177.62 2wvv s ASP 321 N -5.03 3.95 0.00 7.07 -1.08 -1.26 -4.95 116.67 115.37 2wvv s ASP 321 Ca 0.03 -2.79 0.25 0.00 -0.52 0.00 0.00 52.55 49.52 2wvv s ASP 321 Cb 0.09 -1.30 1.46 0.00 -1.46 0.00 0.00 42.92 41.71 2wvv s ASP 321 CO 0.48 -0.25 1.87 0.79 0.52 0.00 0.00 175.17 178.58 2wvv n TRP 322 N 3.36 0.00 0.52 -5.34 7.02 -1.26 -3.26 117.44 118.47 2wvv n TRP 322 Ca 0.07 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.66 2wvv n TRP 322 Cb 0.33 -0.07 0.45 0.00 -2.42 0.00 0.00 31.31 29.61 2wvv n TRP 322 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2wvv n SER 323 N -1.07 0.54 0.21 -0.99 3.41 -1.26 -3.72 113.62 110.74 2wvv n SER 323 Ca 0.17 0.60 0.14 0.00 -0.26 0.00 0.00 58.87 59.53 2wvv n SER 323 Cb 0.11 -0.73 0.48 0.00 -0.26 0.00 0.00 64.21 63.81 2wvv n SER 323 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2wvv h LEU 324 N 0.00 0.00 -8.49 1.04 3.38 -1.99 -3.46 115.31 105.79 2wvv h LEU 324 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 2wvv h LEU 324 Cb 0.44 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.08 2wvv h LEU 324 CO 0.00 0.00 -0.37 -0.94 0.09 0.00 0.00 178.44 177.22 2wvv s SER 325 N -5.33 0.33 0.29 -0.43 1.04 -1.24 -5.08 113.70 103.28 2wvv s SER 325 Ca 0.05 -1.29 -0.29 0.00 0.48 0.00 0.00 55.95 54.90 2wvv s SER 325 Cb 0.09 0.51 -0.10 0.00 0.10 0.00 0.00 66.02 66.62 2wvv s SER 325 CO 0.55 -1.04 1.38 -0.47 0.98 0.00 0.00 173.24 174.65 2wvv s TYR 326 N -3.86 3.01 -0.18 5.02 5.04 -1.26 -4.82 117.35 120.29 2wvv s TYR 326 Ca 0.32 1.20 -0.02 0.00 -2.44 0.00 0.00 57.07 56.13 2wvv s TYR 326 Cb 0.03 -3.77 -0.01 0.00 0.35 0.00 0.00 41.96 38.56 2wvv s TYR 326 CO 0.14 -2.33 -0.08 0.08 -1.34 0.00 0.00 175.55 172.02 2wvv s VAL 327 N -0.55 3.30 0.39 3.14 1.01 -1.26 -2.43 120.40 123.99 2wvv s VAL 327 Ca 0.54 -0.54 -0.26 0.00 0.00 0.00 0.00 61.98 61.72 2wvv s VAL 327 Cb -0.41 -2.45 -0.09 0.00 0.00 0.00 0.00 36.38 33.43 2wvv s VAL 327 CO 0.49 0.47 1.21 -0.54 0.00 0.00 0.00 175.10 176.72 2wvv s LYS 328 N 0.94 4.10 0.68 2.72 1.02 -0.63 -4.99 119.74 123.58 2wvv s LYS 328 Ca -0.01 1.94 -0.11 0.00 0.02 0.00 0.00 55.97 57.81 2wvv s LYS 328 Cb -0.15 -2.76 0.01 0.00 -0.52 0.00 0.00 37.83 34.41 2wvv s LYS 328 CO 0.00 -0.31 1.06 0.95 -0.92 0.00 0.00 175.35 176.13 2wvv s THR 329 N -1.34 3.65 0.27 2.17 -4.23 -1.26 -4.92 115.64 109.99 2wvv s THR 329 Ca 0.55 0.46 -0.03 0.00 -1.18 0.00 0.00 61.69 61.50 2wvv s THR 329 Cb -0.33 -3.52 0.27 0.00 1.34 0.00 0.00 72.50 70.26 2wvv s THR 329 CO 0.42 -0.67 1.91 -0.65 -0.54 0.00 0.00 174.62 175.09 2wvv h PRO 330 N -0.55 1.16 -0.33 3.99 0.11 -1.96 -1.87 132.00 132.54 2wvv h PRO 330 Ca -0.45 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 2wvv h PRO 330 Cb 1.25 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 2wvv h PRO 330 CO 0.63 0.77 -0.09 0.82 -0.21 0.00 0.00 178.00 179.92 2wvv h ILE 331 N 1.19 1.23 -0.51 4.15 2.04 -1.98 0.18 117.51 123.80 2wvv h ILE 331 Ca 0.40 -0.98 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 2wvv h ILE 331 Cb 0.07 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2wvv h ILE 331 CO -0.13 0.33 0.15 -0.33 0.00 0.00 0.00 178.15 178.16 2wvv h GLU 332 N 0.52 0.76 -0.10 2.37 5.08 -1.75 -0.31 114.58 121.15 2wvv h GLU 332 Ca 0.10 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 2wvv h GLU 332 Cb 0.46 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.60 2wvv h GLU 332 CO 0.03 0.67 -0.47 0.28 -1.00 0.00 0.00 179.01 178.52 2wvv h VAL 333 N 0.75 1.37 -1.00 3.13 2.07 -0.73 -3.02 116.25 118.82 2wvv h VAL 333 Ca 0.17 -1.80 0.01 0.00 0.82 0.00 0.00 66.70 65.90 2wvv h VAL 333 Cb 0.24 2.19 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 2wvv h VAL 333 CO -0.01 0.54 0.66 0.40 0.02 0.00 0.00 177.57 179.19 2wvv h ILE 334 N 0.09 1.26 -0.67 4.57 2.04 -0.75 -1.12 117.51 122.93 2wvv h ILE 334 Ca -0.03 -0.47 0.03 0.00 1.00 0.00 0.00 64.86 65.39 2wvv h ILE 334 Cb 1.11 -0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 2wvv h ILE 334 CO 0.10 0.25 0.42 -0.78 0.00 0.00 0.00 178.15 178.13 2wvv h ASP 335 N 1.36 0.68 -0.39 1.72 3.58 -1.06 -0.82 116.42 121.50 2wvv h ASP 335 Ca 0.37 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.69 2wvv h ASP 335 Cb -0.16 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.73 2wvv h ASP 335 CO -0.08 0.47 -0.22 0.03 -2.88 0.00 0.00 179.24 176.56 2wvv h ARG 336 N 0.82 0.89 -0.03 0.28 3.08 -1.24 0.62 114.38 118.80 2wvv h ARG 336 Ca 0.27 -0.37 0.01 0.00 0.07 0.00 0.00 59.98 59.95 2wvv h ARG 336 Cb 0.02 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2wvv h ARG 336 CO -0.11 1.02 -0.01 0.82 -1.07 0.00 0.00 179.97 180.62 2wvv h ILE 337 N 0.77 0.97 -0.49 2.04 2.04 -0.73 -2.01 117.51 120.10 2wvv h ILE 337 Ca 0.10 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.84 2wvv h ILE 337 Cb 0.77 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2wvv h ILE 337 CO 0.06 0.00 -0.17 0.58 0.00 0.00 0.00 178.15 178.62 2wvv h VAL 338 N -0.00 1.27 -0.35 1.67 2.07 -0.99 -2.34 116.25 117.57 2wvv h VAL 338 Ca 0.02 -1.33 0.06 0.00 0.82 0.00 0.00 66.70 66.27 2wvv h VAL 338 Cb 0.03 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 2wvv h VAL 338 CO -0.03 0.46 0.02 -0.74 0.02 0.00 0.00 177.57 177.30 2wvv h HIS 339 N 0.85 0.03 0.11 1.57 -0.00 -0.76 0.11 115.15 117.04 2wvv h HIS 339 Ca 0.12 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.51 2wvv h HIS 339 Cb 0.73 0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.19 2wvv h HIS 339 CO 0.05 -0.04 -0.05 0.00 -0.00 0.00 0.00 177.93 177.89 2wvv h ALA 340 N 1.29 -0.14 -0.75 5.26 0.00 -1.09 -2.71 119.26 121.12 2wvv h ALA 340 Ca 0.17 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2wvv h ALA 340 Cb 0.22 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2wvv h ALA 340 CO -0.27 -0.58 0.50 0.28 0.00 0.00 0.00 179.25 179.18 2wvv h VAL 341 N -0.14 1.20 -0.04 0.00 2.07 -1.08 0.63 116.25 118.88 2wvv h VAL 341 Ca -0.01 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.16 2wvv h VAL 341 Cb 0.11 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2wvv h VAL 341 CO 0.02 0.19 0.15 0.77 0.02 0.00 0.00 177.57 178.72 2wvv h SER 342 N 1.02 0.00 -0.23 0.57 4.64 -0.56 -0.31 113.55 118.69 2wvv h SER 342 Ca 0.28 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.56 2wvv h SER 342 Cb -0.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 2wvv h SER 342 CO -0.06 0.00 -0.02 0.23 -0.87 0.00 0.00 176.83 176.11 2wvv n MET 343 N -3.20 2.41 -1.11 4.77 2.81 -0.48 -4.14 117.12 118.17 2wvv n MET 343 Ca -0.02 -2.86 0.00 0.00 -1.81 0.00 0.00 57.70 53.01 2wvv n MET 343 Cb 0.22 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.96 2wvv n MET 343 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wvv n GLY 344 N -0.80 0.41 3.49 3.03 0.00 -0.13 -4.22 105.19 106.97 2wvv n GLY 344 Ca 0.23 -1.03 -0.24 0.00 0.00 0.00 0.00 46.02 44.98 2wvv n GLY 344 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wvv s GLY 345 N -2.96 1.98 0.46 -0.02 0.00 0.09 -4.33 107.32 102.55 2wvv s GLY 345 Ca 0.00 -1.96 -0.07 0.00 0.00 0.00 0.00 44.72 42.69 2wvv s GLY 345 CO 0.00 -1.96 0.79 -1.31 0.00 0.00 0.00 173.10 170.62 2wvv s ASN 346 N -3.53 6.33 -0.03 1.64 -0.87 -0.36 -2.78 114.94 115.35 2wvv s ASN 346 Ca 0.30 1.01 0.03 0.00 -1.57 0.00 0.00 52.86 52.64 2wvv s ASN 346 Cb -0.00 -2.28 -0.00 0.00 -0.02 0.00 0.00 41.25 38.95 2wvv s ASN 346 CO 0.15 -0.54 -0.13 -0.32 -2.57 0.00 0.00 177.10 173.69 2wvv s MET 347 N -4.50 1.30 -0.16 -0.60 -2.45 -0.44 -0.74 119.30 111.71 2wvv s MET 347 Ca 0.49 -0.45 0.02 0.00 -1.25 0.00 0.00 55.69 54.49 2wvv s MET 347 Cb -0.10 -1.18 0.02 0.00 1.25 0.00 0.00 34.83 34.81 2wvv s MET 347 CO 0.41 0.19 -0.20 0.08 1.05 0.00 0.00 175.02 176.56 2wvv s VAL 348 N 0.05 2.01 -0.21 10.11 1.01 -0.30 -1.17 120.40 131.89 2wvv s VAL 348 Ca -0.02 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.92 2wvv s VAL 348 Cb -0.09 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 2wvv s VAL 348 CO 0.01 0.54 0.18 -0.69 0.00 0.00 0.00 175.10 175.13 2wvv s VAL 349 N 1.08 5.37 0.25 2.92 1.01 -0.48 -1.60 120.40 128.95 2wvv s VAL 349 Ca -0.01 0.26 -0.23 0.00 0.00 0.00 0.00 61.98 62.00 2wvv s VAL 349 Cb -0.14 -3.52 -0.09 0.00 0.00 0.00 0.00 36.38 32.64 2wvv s VAL 349 CO -0.08 0.39 0.81 0.21 0.00 0.00 0.00 175.10 176.43 2wvv s ASN 350 N 0.69 7.19 0.02 3.32 2.47 -0.36 -0.68 114.94 127.60 2wvv s ASN 350 Ca 0.09 1.59 0.05 0.00 0.42 0.00 0.00 52.86 55.02 2wvv s ASN 350 Cb -0.12 -2.49 -0.02 0.00 -1.45 0.00 0.00 41.25 37.17 2wvv s ASN 350 CO 0.02 0.01 -0.15 -0.36 -3.72 0.00 0.00 177.10 172.90 2wvv s PHE 351 N -1.52 1.35 -0.56 0.43 0.08 0.63 -4.51 117.98 113.87 2wvv s PHE 351 Ca 0.45 -0.31 0.04 0.00 0.12 0.00 0.00 56.93 57.23 2wvv s PHE 351 Cb -0.18 -0.83 0.15 0.00 -0.57 0.00 0.00 43.02 41.59 2wvv s PHE 351 CO 0.22 0.02 0.34 0.20 -0.10 0.00 0.00 175.22 175.90 2wvv s GLY 352 N -0.82 2.42 0.60 4.36 0.00 -1.25 -1.47 107.32 111.16 2wvv s GLY 352 Ca 0.04 -3.31 -0.19 0.00 0.00 0.00 0.00 44.72 41.27 2wvv s GLY 352 CO 0.01 1.18 1.02 -1.05 0.00 0.00 0.00 173.10 174.25 2wvv n PRO 353 N 2.80 0.97 -0.89 2.90 -0.02 -1.24 -4.00 135.00 135.50 2wvv n PRO 353 Ca 0.12 0.37 -0.31 0.00 -2.02 0.00 0.00 63.50 61.66 2wvv n PRO 353 Cb 0.34 -2.23 0.15 0.00 -0.02 0.00 0.00 33.50 31.74 2wvv n PRO 353 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2wvv s GLN 354 N -2.83 1.32 0.48 -0.52 -0.21 0.06 -4.44 119.66 113.53 2wvv s GLN 354 Ca 0.76 1.35 0.15 0.00 0.02 0.00 0.00 55.36 57.64 2wvv s GLN 354 Cb -0.41 -1.78 1.14 0.00 1.00 0.00 0.00 33.01 32.96 2wvv s GLN 354 CO 0.46 -2.36 2.08 0.00 -2.12 0.00 0.00 175.29 173.36 2wvv h ALA 355 N -1.66 1.86 0.00 6.09 0.00 -1.87 -1.72 119.26 121.96 2wvv h ALA 355 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2wvv h ALA 355 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2wvv h ALA 355 CO 0.46 0.11 0.00 -0.40 0.00 0.00 0.00 179.25 179.41 2wvv n ASP 356 N -4.45 0.02 0.00 0.00 5.68 -1.26 -4.02 116.55 112.52 2wvv n ASP 356 Ca -0.02 0.50 0.00 0.00 -0.50 0.00 0.00 54.79 54.77 2wvv n ASP 356 Cb 0.15 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 39.62 2wvv n ASP 356 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wvv n GLY 357 N 0.55 0.63 3.92 6.12 0.00 -0.65 -0.76 105.19 115.01 2wvv n GLY 357 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 2wvv n GLY 357 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wvv s ASP 358 N -2.75 5.43 -0.06 1.61 2.15 -1.26 -3.91 116.67 117.88 2wvv s ASP 358 Ca 0.00 -0.50 -0.05 0.00 0.43 0.00 0.00 52.55 52.43 2wvv s ASP 358 Cb 0.00 -0.81 -0.04 0.00 -0.30 0.00 0.00 42.92 41.77 2wvv s ASP 358 CO 0.00 -0.57 0.18 -0.36 -0.17 0.00 0.00 175.17 174.25 2wvv s PHE 359 N -2.35 3.58 0.81 -5.34 0.08 -1.26 -0.76 117.98 112.74 2wvv s PHE 359 Ca 0.48 0.47 -0.12 0.00 0.12 0.00 0.00 56.93 57.87 2wvv s PHE 359 Cb -0.07 -1.90 0.09 0.00 -0.57 0.00 0.00 43.02 40.57 2wvv s PHE 359 CO 0.29 0.69 1.15 -0.98 -0.10 0.00 0.00 175.22 176.27 2wvv s ARG 360 N -1.50 1.73 0.35 0.44 1.70 -1.26 -4.78 118.95 115.62 2wvv s ARG 360 Ca 0.22 1.52 0.04 0.00 -0.47 0.00 0.00 55.73 57.04 2wvv s ARG 360 Cb -0.12 -1.81 0.63 0.00 -0.57 0.00 0.00 34.95 33.08 2wvv s ARG 360 CO 0.12 -2.10 1.92 -1.00 -1.08 0.00 0.00 175.30 173.16 2wvv h PRO 361 N -1.12 0.60 -0.86 3.89 0.13 -1.99 -1.87 132.00 130.79 2wvv h PRO 361 Ca -0.45 -0.10 0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2wvv h PRO 361 Cb 1.27 -0.11 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 2wvv h PRO 361 CO 0.47 0.54 0.57 0.93 -0.23 0.00 0.00 178.00 180.27 2wvv h GLU 362 N 0.60 1.09 -0.01 0.86 3.07 -1.99 0.32 114.58 118.51 2wvv h GLU 362 Ca 0.14 -0.07 -0.22 0.00 -0.50 0.00 0.00 59.36 58.72 2wvv h GLU 362 Cb 0.19 -0.25 0.00 0.00 -0.84 0.00 0.00 28.75 27.86 2wvv h GLU 362 CO -0.01 0.72 -0.90 0.93 -1.40 0.00 0.00 179.01 178.36 2wvv h GLU 363 N 1.13 0.40 -0.52 2.33 5.08 -1.78 -1.59 114.58 119.62 2wvv h GLU 363 Ca 0.32 -0.41 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 2wvv h GLU 363 Cb -0.08 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2wvv h GLU 363 CO -0.08 1.08 0.08 0.87 -1.00 0.00 0.00 179.01 179.96 2wvv h LYS 364 N 0.23 0.87 -0.71 2.33 1.57 -0.69 -0.46 116.57 119.71 2wvv h LYS 364 Ca -0.07 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 2wvv h LYS 364 Cb 1.53 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.70 2wvv h LYS 364 CO 0.16 0.85 0.41 0.00 -0.57 0.00 0.00 179.45 180.30 2wvv h ALA 365 N 0.98 0.90 -0.07 3.86 0.00 -0.89 -2.05 119.26 121.98 2wvv h ALA 365 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2wvv h ALA 365 Cb 0.41 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wvv h ALA 365 CO 0.01 0.39 0.02 1.98 0.00 0.00 0.00 179.25 181.65 2wvv h MET 366 N 0.96 0.12 -0.75 0.00 1.85 -1.03 -1.49 114.93 114.60 2wvv h MET 366 Ca 0.25 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.32 2wvv h MET 366 Cb -0.01 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 31.97 2wvv h MET 366 CO -0.05 0.28 0.48 0.00 -0.40 0.00 0.00 176.91 177.22 2wvv h ALA 367 N 0.83 0.95 -0.53 0.39 0.00 -0.95 0.23 119.26 120.19 2wvv h ALA 367 Ca 0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2wvv h ALA 367 Cb 0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2wvv h ALA 367 CO -0.00 0.39 0.16 1.15 0.00 0.00 0.00 179.25 180.96 2wvv h THR 368 N 1.02 1.23 -0.39 0.00 2.02 -1.29 0.24 112.91 115.74 2wvv h THR 368 Ca 0.27 -0.79 -0.07 0.00 0.77 0.00 0.00 66.41 66.59 2wvv h THR 368 Cb -0.08 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 2wvv h THR 368 CO -0.06 0.29 -0.05 0.00 0.37 0.00 0.00 175.52 176.08 2wvv h ALA 369 N 1.03 0.53 -0.60 6.16 0.00 -0.65 -0.52 119.26 125.19 2wvv h ALA 369 Ca 0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 2wvv h ALA 369 Cb 0.28 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2wvv h ALA 369 CO -0.01 0.35 0.22 0.82 0.00 0.00 0.00 179.25 180.63 2wvv h ILE 370 N 0.53 1.23 -0.60 0.00 2.04 -0.90 -2.66 117.51 117.15 2wvv h ILE 370 Ca 0.10 -0.76 0.06 0.00 1.00 0.00 0.00 64.86 65.26 2wvv h ILE 370 Cb 0.54 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 2wvv h ILE 370 CO 0.03 0.29 0.31 1.23 0.00 0.00 0.00 178.15 180.01 2wvv h GLY 371 N 0.85 0.86 1.00 5.37 0.00 -0.50 0.68 103.07 111.33 2wvv h GLY 371 Ca 0.20 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wvv h GLY 371 CO -0.01 0.12 0.30 0.50 0.00 0.00 0.00 176.54 177.44 2wvv h LYS 372 N 0.58 0.59 -0.26 4.80 1.57 -0.92 0.27 116.57 123.20 2wvv h LYS 372 Ca 0.27 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.94 2wvv h LYS 372 Cb 0.19 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2wvv h LYS 372 CO -0.19 0.39 -0.12 2.35 -0.57 0.00 0.00 179.45 181.31 2wvv h TRP 373 N 0.61 0.63 -0.42 -1.35 7.01 -1.11 -2.86 115.95 118.46 2wvv h TRP 373 Ca 0.16 -0.15 -0.05 0.00 2.11 0.00 0.00 58.89 60.96 2wvv h TRP 373 Cb -0.07 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 26.82 2wvv h TRP 373 CO -0.04 0.80 0.04 0.52 -2.79 0.00 0.00 178.44 176.97 2wvv h MET 374 N 0.28 0.65 -0.64 2.65 2.86 -0.67 0.14 114.93 120.20 2wvv h MET 374 Ca 0.06 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2wvv h MET 374 Cb 0.63 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.16 2wvv h MET 374 CO 0.04 0.64 0.41 -0.97 1.06 0.00 0.00 176.91 178.09 2wvv h ASN 375 N 0.63 0.74 0.20 1.22 -1.24 -0.78 0.92 115.58 117.26 2wvv h ASN 375 Ca 0.14 -0.02 -0.34 0.00 0.71 0.00 0.00 56.30 56.78 2wvv h ASN 375 Cb 0.33 -0.18 0.02 0.00 0.73 0.00 0.00 38.32 39.21 2wvv h ASN 375 CO 0.01 0.54 -1.67 0.03 -1.29 0.00 0.00 177.43 175.05 2wvv h ARG 376 N 0.87 0.42 -0.01 6.67 3.08 -1.12 -3.42 114.38 120.88 2wvv h ARG 376 Ca 0.23 -0.72 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2wvv h ARG 376 Cb -0.08 0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2wvv h ARG 376 CO -0.05 1.34 0.00 0.66 -1.07 0.00 0.00 179.97 180.86 2wvv n TYR 377 N -3.65 0.01 0.26 3.04 4.01 0.40 -4.76 117.16 116.47 2wvv n TYR 377 Ca -0.23 -0.10 0.16 0.00 -0.16 0.00 0.00 57.90 57.57 2wvv n TYR 377 Cb 1.07 -0.01 0.83 0.00 -0.31 0.00 0.00 39.34 40.92 2wvv n TYR 377 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2wvv h GLY 378 N 0.21 0.00 0.83 2.72 0.00 -0.97 -0.78 103.07 105.08 2wvv h GLY 378 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.50 2wvv h GLY 378 CO 0.00 0.00 0.42 1.70 0.00 0.00 0.00 176.54 178.66 2wvv h LYS 379 N 0.00 0.03 -0.00 4.80 3.64 -1.86 0.14 116.57 123.32 2wvv h LYS 379 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wvv h LYS 379 Cb 0.07 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2wvv h LYS 379 CO 0.00 0.02 -0.09 0.00 -2.27 0.00 0.00 179.45 177.11 2wvv n ALA 380 N -2.64 2.74 0.01 5.00 0.00 -0.30 -4.41 120.51 120.90 2wvv n ALA 380 Ca 0.11 -0.29 -0.03 0.00 0.00 0.00 0.00 53.44 53.23 2wvv n ALA 380 Cb 0.64 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 2wvv n ALA 380 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wvv n VAL 381 N -0.78 1.11 -2.09 0.00 0.31 -0.11 -4.79 118.33 111.98 2wvv n VAL 381 Ca 0.16 0.26 -0.41 0.00 -0.01 0.00 0.00 64.34 64.34 2wvv n VAL 381 Cb 0.27 -1.73 -0.03 0.00 -0.91 0.00 0.00 33.84 31.44 2wvv n VAL 381 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2wvv s TYR 382 N -2.19 3.11 -1.72 3.52 2.02 -0.32 -2.31 117.35 119.45 2wvv s TYR 382 Ca -0.07 1.10 0.00 0.00 -0.37 0.00 0.00 57.07 57.73 2wvv s TYR 382 Cb 0.01 -3.74 0.00 0.00 -0.40 0.00 0.00 41.96 37.84 2wvv s TYR 382 CO 0.10 -2.37 0.00 0.00 -1.57 0.00 0.00 175.55 171.71 2wvv n ALA 383 N 2.41 -0.58 -2.37 3.71 0.00 -0.22 -4.88 120.51 118.59 2wvv n ALA 383 Ca 0.06 0.19 -0.23 0.00 0.00 0.00 0.00 53.44 53.46 2wvv n ALA 383 Cb 0.41 -2.03 -0.05 0.00 0.00 0.00 0.00 19.45 17.77 2wvv n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvv s ASP 385 N -3.98 0.10 0.25 0.00 -1.08 -0.34 -4.91 116.67 106.71 2wvv s ASP 385 Ca 0.43 -1.13 -0.31 0.00 -0.52 0.00 0.00 52.55 51.02 2wvv s ASP 385 Cb -0.00 0.81 -0.12 0.00 -1.46 0.00 0.00 42.92 42.14 2wvv s ASP 385 CO 0.25 -1.58 1.55 0.00 0.52 0.00 0.00 175.17 175.90 2wvv n TYR 386 N -0.52 2.56 0.47 -5.34 9.36 -1.23 -0.82 117.16 121.63 2wvv n TYR 386 Ca -0.06 0.29 0.11 0.00 3.32 0.00 0.00 57.90 61.56 2wvv n TYR 386 Cb 0.60 -2.56 0.05 0.00 -0.63 0.00 0.00 39.34 36.80 2wvv n TYR 386 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wvv n ALA 387 N 2.43 3.12 -0.95 2.98 0.00 -1.26 -4.64 120.51 122.19 2wvv n ALA 387 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2wvv n ALA 387 Cb 0.34 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2wvv n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wvv n GLY 388 N 1.33 0.48 3.86 0.00 0.00 -1.26 -4.99 105.19 104.60 2wvv n GLY 388 Ca 0.02 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 2wvv n GLY 388 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvv s PHE 389 N -2.00 3.39 0.19 1.61 0.40 -1.26 -4.71 117.98 115.60 2wvv s PHE 389 Ca 0.00 0.19 -0.32 0.00 -0.60 0.00 0.00 56.93 56.21 2wvv s PHE 389 Cb 0.00 -1.71 -0.11 0.00 0.51 0.00 0.00 43.02 41.71 2wvv s PHE 389 CO 0.00 0.57 1.62 -2.00 0.70 0.00 0.00 175.22 176.11 2wvv s GLU 390 N -2.38 4.18 0.24 0.44 2.12 -1.26 -4.94 118.70 117.10 2wvv s GLU 390 Ca 0.32 2.46 -0.31 0.00 0.36 0.00 0.00 54.97 57.79 2wvv s GLU 390 Cb -0.13 -3.12 -0.13 0.00 0.26 0.00 0.00 34.13 31.02 2wvv s GLU 390 CO 0.24 -0.66 1.51 1.17 -0.54 0.00 0.00 175.26 176.98 2wvv n LYS 391 N 3.86 2.30 -4.47 4.30 3.00 -1.26 -4.82 118.16 121.06 2wvv n LYS 391 Ca 0.14 0.82 -0.24 0.00 -0.00 0.00 0.00 58.31 59.03 2wvv n LYS 391 Cb 0.37 -2.54 -0.10 0.00 0.00 0.00 0.00 35.03 32.76 2wvv n LYS 391 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2wvv s GLN 392 N -0.17 1.74 0.50 1.64 -1.52 -1.26 -5.06 119.66 115.53 2wvv s GLN 392 Ca 0.69 -1.78 0.29 0.00 -1.95 0.00 0.00 55.36 52.60 2wvv s GLN 392 Cb -0.60 -1.78 1.08 0.00 -0.22 0.00 0.00 33.01 31.50 2wvv s GLN 392 CO 0.47 0.29 1.88 -0.44 -0.25 0.00 0.00 175.29 177.24 2wvv h ASP 393 N 2.20 0.00 0.83 5.90 3.32 -1.96 -3.15 116.42 123.57 2wvv h ASP 393 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2wvv h ASP 393 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2wvv h ASP 393 CO 0.62 0.08 0.00 4.11 -1.72 0.00 0.00 179.24 182.33 2wvv h TRP 394 N 0.00 0.00 0.00 4.55 5.08 -1.96 -3.43 115.95 120.20 2wvv h TRP 394 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2wvv h TRP 394 Cb 0.66 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.82 2wvv h TRP 394 CO 0.00 0.00 0.00 0.41 -1.28 0.00 0.00 178.44 177.57 2wvv n GLY 395 N -0.06 -0.12 3.16 11.11 0.00 -1.19 -0.40 105.19 117.68 2wvv n GLY 395 Ca 0.01 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 2wvv n GLY 395 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvv s TYR 396 N -1.96 1.27 0.11 1.61 2.02 -0.24 -4.39 117.35 115.77 2wvv s TYR 396 Ca 0.00 -0.37 -0.08 0.00 -0.37 0.00 0.00 57.07 56.25 2wvv s TYR 396 Cb 0.00 -0.75 -0.06 0.00 -0.40 0.00 0.00 41.96 40.75 2wvv s TYR 396 CO 0.00 0.04 0.40 0.71 -1.57 0.00 0.00 175.55 175.13 2wvv s TYR 397 N -0.90 3.53 0.11 2.71 2.02 -1.26 -0.12 117.35 123.44 2wvv s TYR 397 Ca 0.02 0.70 0.03 0.00 -0.37 0.00 0.00 57.07 57.44 2wvv s TYR 397 Cb -0.08 -2.10 -0.04 0.00 -0.40 0.00 0.00 41.96 39.33 2wvv s TYR 397 CO 0.01 0.47 -0.08 0.95 -1.57 0.00 0.00 175.55 175.34 2wvv s THR 398 N -1.52 0.87 -0.09 -0.71 -4.23 -0.32 -4.40 115.64 105.24 2wvv s THR 398 Ca 0.37 -1.93 0.04 0.00 -1.18 0.00 0.00 61.69 58.98 2wvv s THR 398 Cb -0.13 -1.68 0.00 0.00 1.34 0.00 0.00 72.50 72.03 2wvv s THR 398 CO 0.20 -0.79 -0.21 -0.60 -0.54 0.00 0.00 174.62 172.68 2wvv s ARG 399 N -3.66 2.69 0.96 3.99 3.52 0.00 0.18 118.95 126.63 2wvv s ARG 399 Ca 0.12 -0.77 -0.16 0.00 -0.13 0.00 0.00 55.73 54.79 2wvv s ARG 399 Cb 0.03 -2.07 0.19 0.00 -1.56 0.00 0.00 34.95 31.54 2wvv s ARG 399 CO -0.02 0.16 1.28 0.20 -0.81 0.00 0.00 175.30 176.11 2wvv s GLY 400 N 0.36 1.73 0.51 8.12 0.00 0.21 -1.20 107.32 117.06 2wvv s GLY 400 Ca -0.16 -1.08 0.29 0.00 0.00 0.00 0.00 44.72 43.77 2wvv s GLY 400 CO 0.07 -0.35 1.98 1.70 0.00 0.00 0.00 173.10 176.50 2wvv h LYS 401 N -1.65 0.00 -0.71 2.90 3.64 -1.89 -2.90 116.57 115.96 2wvv h LYS 401 Ca -0.45 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.41 2wvv h LYS 401 Cb 1.26 0.00 -0.39 0.00 -0.41 0.00 0.00 32.23 32.68 2wvv h LYS 401 CO 0.42 0.11 -0.72 0.09 -2.27 0.00 0.00 179.45 177.08 2wvv n ASN 402 N -3.33 4.82 -1.11 4.20 4.13 -1.26 -4.95 115.26 117.76 2wvv n ASN 402 Ca -0.00 -3.76 -0.14 0.00 1.68 0.00 0.00 54.58 52.35 2wvv n ASN 402 Cb 0.32 -0.38 -0.06 0.00 -1.54 0.00 0.00 39.78 38.11 2wvv n ASN 402 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2wvv n ASP 403 N -0.75 -4.83 -4.77 6.41 8.00 -1.09 -4.99 116.55 114.53 2wvv n ASP 403 Ca 0.43 0.36 -0.41 0.00 0.71 0.00 0.00 54.79 55.88 2wvv n ASP 403 Cb 0.94 -3.61 -0.02 0.00 -0.02 0.00 0.00 41.12 38.42 2wvv n ASP 403 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2wvv s GLU 404 N -3.20 4.26 -0.16 -1.24 8.01 -1.26 -4.62 118.70 120.48 2wvv s GLU 404 Ca 0.00 2.35 -0.00 0.00 0.01 0.00 0.00 54.97 57.33 2wvv s GLU 404 Cb 0.00 -3.05 -0.01 0.00 -4.31 0.00 0.00 34.13 26.77 2wvv s GLU 404 CO 0.00 -0.35 -0.13 0.08 0.01 0.00 0.00 175.26 174.87 2wvv s VAL 405 N -0.89 2.85 -0.11 2.63 1.01 -1.08 -0.62 120.40 124.20 2wvv s VAL 405 Ca 0.52 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2wvv s VAL 405 Cb -0.42 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 2wvv s VAL 405 CO 0.54 0.51 -0.06 -0.31 0.00 0.00 0.00 175.10 175.78 2wvv s TYR 406 N 0.79 2.97 -0.29 5.22 2.02 0.13 0.35 117.35 128.54 2wvv s TYR 406 Ca -0.05 -0.19 -0.10 0.00 -0.37 0.00 0.00 57.07 56.36 2wvv s TYR 406 Cb -0.15 -1.84 -0.03 0.00 -0.40 0.00 0.00 41.96 39.54 2wvv s TYR 406 CO 0.01 0.11 0.16 -1.64 -1.57 0.00 0.00 175.55 172.61 2wvv s MET 407 N -0.15 3.65 -0.35 -0.62 -1.94 0.45 -1.18 119.30 119.16 2wvv s MET 407 Ca 0.02 -0.51 -0.09 0.00 -1.71 0.00 0.00 55.69 53.41 2wvv s MET 407 Cb -0.13 -3.58 0.03 0.00 2.01 0.00 0.00 34.83 33.17 2wvv s MET 407 CO 0.03 -0.28 0.15 0.08 -0.01 0.00 0.00 175.02 174.98 2wvv s VAL 408 N 1.68 4.17 -0.34 -6.03 1.01 0.82 -0.88 120.40 120.84 2wvv s VAL 408 Ca 0.06 -0.97 -0.15 0.00 0.00 0.00 0.00 61.98 60.92 2wvv s VAL 408 Cb -0.16 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 2wvv s VAL 408 CO 0.08 -0.19 0.35 -0.69 0.00 0.00 0.00 175.10 174.65 2wvv s VAL 409 N 1.48 5.18 -0.05 2.92 1.01 0.36 -1.08 120.40 130.23 2wvv s VAL 409 Ca 0.00 0.02 0.15 0.00 0.00 0.00 0.00 61.98 62.15 2wvv s VAL 409 Cb -0.19 -3.81 -0.23 0.00 0.00 0.00 0.00 36.38 32.15 2wvv s VAL 409 CO 0.05 -0.09 0.28 0.49 0.00 0.00 0.00 175.10 175.83 2wvv n PHE 410 N 5.36 0.00 -3.82 5.22 3.72 0.46 -2.14 117.46 126.26 2wvv n PHE 410 Ca -0.09 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.01 2wvv n PHE 410 Cb 0.49 -0.43 -0.16 0.00 -0.94 0.00 0.00 39.48 38.45 2wvv n PHE 410 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2wvv s ASN 411 N -3.99 3.61 -0.25 4.37 0.01 -0.55 -4.90 114.94 113.25 2wvv s ASN 411 Ca -0.06 -1.22 -0.25 0.00 -0.71 0.00 0.00 52.86 50.62 2wvv s ASN 411 Cb 0.09 -0.91 -0.00 0.00 0.41 0.00 0.00 41.25 40.83 2wvv s ASN 411 CO 0.63 -0.32 0.83 -1.58 -1.51 0.00 0.00 177.10 175.16 2wvv s GLN 412 N 1.60 4.17 0.07 -0.60 2.00 -1.26 -4.41 119.66 121.23 2wvv s GLN 412 Ca 0.01 0.93 -0.30 0.00 -2.00 0.00 0.00 55.36 54.00 2wvv s GLN 412 Cb -0.18 -3.65 -0.05 0.00 0.80 0.00 0.00 33.01 29.93 2wvv s GLN 412 CO -0.12 -0.53 1.14 -1.25 -0.50 0.00 0.00 175.29 174.03 2wvv s PRO 413 N 2.86 4.48 0.57 1.67 0.04 -1.26 -4.92 135.00 138.44 2wvv s PRO 413 Ca 0.35 1.69 0.26 0.00 0.04 0.00 0.00 61.00 63.34 2wvv s PRO 413 Cb -0.15 -3.36 1.63 0.00 0.04 0.00 0.00 34.50 32.66 2wvv s PRO 413 CO 0.07 -0.17 2.17 1.88 0.04 0.00 0.00 177.00 181.00 2wvv h TYR 414 N 6.55 0.00 0.00 0.56 0.05 -1.95 -0.68 116.97 121.51 2wvv h TYR 414 Ca -0.42 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.36 2wvv h TYR 414 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 2wvv h TYR 414 CO 0.66 0.00 0.00 0.66 -1.05 0.00 0.00 178.16 178.43 2wvv h SER 415 N 0.00 0.00 -0.58 3.88 4.64 -2.03 -3.45 113.55 116.01 2wvv h SER 415 Ca 0.04 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.12 2wvv h SER 415 Cb 0.23 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.22 2wvv h SER 415 CO -0.00 0.00 -0.22 -0.62 -0.87 0.00 0.00 176.83 175.11 2wvv n GLU 416 N -2.32 -1.23 -4.38 4.77 1.02 -0.26 -4.98 120.64 113.26 2wvv n GLU 416 Ca -0.00 0.90 -0.23 0.00 -0.02 0.00 0.00 57.16 57.81 2wvv n GLU 416 Cb 0.11 -5.08 -0.16 0.00 -0.02 0.00 0.00 31.44 26.29 2wvv n GLU 416 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2wvv s ARG 417 N -2.91 1.31 -0.34 3.49 0.52 -1.26 -2.13 118.95 117.63 2wvv s ARG 417 Ca 0.00 -0.27 -0.11 0.00 -0.52 0.00 0.00 55.73 54.83 2wvv s ARG 417 Cb 0.00 -1.16 0.01 0.00 0.52 0.00 0.00 34.95 34.31 2wvv s ARG 417 CO 0.00 -0.03 0.19 -0.51 0.02 0.00 0.00 175.30 174.96 2wvv s LEU 418 N 0.81 4.40 0.12 2.53 1.43 0.15 -4.82 118.68 123.30 2wvv s LEU 418 Ca -0.12 -0.70 -0.31 0.00 -1.03 0.00 0.00 54.13 51.98 2wvv s LEU 418 Cb -0.15 -2.03 -0.07 0.00 0.03 0.00 0.00 46.19 43.97 2wvv s LEU 418 CO 0.02 -0.28 1.26 -0.63 0.23 0.00 0.00 176.35 176.95 2wvv s ILE 419 N 1.60 3.65 -0.18 -0.59 1.01 -1.26 -0.95 121.20 124.49 2wvv s ILE 419 Ca 0.04 1.24 -0.00 0.00 0.00 0.00 0.00 60.65 61.93 2wvv s ILE 419 Cb -0.18 -3.80 0.04 0.00 0.01 0.00 0.00 42.46 38.54 2wvv s ILE 419 CO 0.07 0.13 -0.06 -0.69 0.00 0.00 0.00 174.94 174.39 2wvv s VAL 420 N 0.72 1.19 -0.26 2.92 1.01 0.14 -4.91 120.40 121.21 2wvv s VAL 420 Ca 0.59 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 2wvv s VAL 420 Cb -0.33 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 2wvv s VAL 420 CO 0.32 0.10 0.12 -1.59 0.00 0.00 0.00 175.10 174.05 2wvv s LYS 421 N 1.59 3.73 0.28 2.72 -2.85 -1.26 -0.51 119.74 123.44 2wvv s LYS 421 Ca -0.00 -0.44 -0.08 0.00 -1.00 0.00 0.00 55.97 54.44 2wvv s LYS 421 Cb -0.16 -3.45 -0.06 0.00 -2.06 0.00 0.00 37.83 32.10 2wvv s LYS 421 CO -0.08 -0.20 0.59 0.95 0.10 0.00 0.00 175.35 176.71 2wvv s THR 422 N 1.66 4.94 0.93 3.79 -4.23 0.18 -4.25 115.64 118.66 2wvv s THR 422 Ca 0.06 0.35 -0.11 0.00 -1.18 0.00 0.00 61.69 60.82 2wvv s THR 422 Cb -0.16 -3.68 0.15 0.00 1.34 0.00 0.00 72.50 70.16 2wvv s THR 422 CO 0.06 -0.24 1.12 -2.84 -0.54 0.00 0.00 174.62 172.19 2wvv s PRO 423 N -3.25 0.89 0.23 3.99 0.02 -1.26 -4.88 135.00 130.73 2wvv s PRO 423 Ca 0.47 1.36 -0.32 0.00 0.02 0.00 0.00 61.00 62.53 2wvv s PRO 423 Cb -0.11 -1.73 -0.12 0.00 0.02 0.00 0.00 34.50 32.56 2wvv s PRO 423 CO 0.26 -2.66 1.61 0.36 -0.33 0.00 0.00 177.00 176.25 2wvv n LYS 424 N -4.23 2.53 -0.72 5.54 0.00 -1.26 -2.30 118.16 117.73 2wvv n LYS 424 Ca 0.10 0.91 0.00 0.00 -0.00 0.00 0.00 58.31 59.32 2wvv n LYS 424 Cb 0.53 -2.70 0.00 0.00 -0.00 0.00 0.00 35.03 32.86 2wvv n LYS 424 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wvv n GLY 425 N 3.07 0.65 3.25 2.58 0.00 -1.26 -5.00 105.19 108.48 2wvv n GLY 425 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 2wvv n GLY 425 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvv s ILE 426 N -2.05 2.10 0.20 -0.61 -1.09 -0.97 0.10 121.20 118.88 2wvv s ILE 426 Ca 0.00 -1.03 0.11 0.00 -2.23 0.00 0.00 60.65 57.49 2wvv s ILE 426 Cb 0.00 -1.78 -0.04 0.00 -1.58 0.00 0.00 42.46 39.06 2wvv s ILE 426 CO 0.00 0.57 -0.18 0.42 -1.23 0.00 0.00 174.94 174.51 2wvv s THR 427 N 0.04 2.65 -0.27 2.92 -4.23 0.19 -4.72 115.64 112.22 2wvv s THR 427 Ca -0.10 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.33 2wvv s THR 427 Cb -0.15 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.33 2wvv s THR 427 CO 0.06 -0.16 0.19 -0.69 -0.54 0.00 0.00 174.62 173.47 2wvv s VAL 428 N -1.81 5.32 -0.12 2.29 1.01 -1.26 -1.35 120.40 124.47 2wvv s VAL 428 Ca 0.24 0.17 0.20 0.00 0.00 0.00 0.00 61.98 62.59 2wvv s VAL 428 Cb -0.08 -3.53 -0.27 0.00 0.00 0.00 0.00 36.38 32.51 2wvv s VAL 428 CO 0.12 0.27 0.36 -0.62 0.00 0.00 0.00 175.10 175.23 2wvv n GLU 429 N 4.92 0.67 -3.56 2.72 1.02 0.13 -5.01 120.64 121.53 2wvv n GLU 429 Ca -0.14 -0.06 -0.13 0.00 -0.02 0.00 0.00 57.16 56.81 2wvv n GLU 429 Cb 0.52 -1.56 -0.05 0.00 -0.02 0.00 0.00 31.44 30.32 2wvv n GLU 429 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2wvv s LYS 430 N -3.01 0.76 0.01 3.49 2.20 -1.21 -4.99 119.74 117.00 2wvv s LYS 430 Ca -0.08 0.20 0.05 0.00 -0.36 0.00 0.00 55.97 55.78 2wvv s LYS 430 Cb 0.10 0.36 -0.02 0.00 -1.51 0.00 0.00 37.83 36.76 2wvv s LYS 430 CO 0.86 -0.23 -0.15 0.00 -0.36 0.00 0.00 175.35 175.46 2wvv s ALA 431 N -1.11 1.27 -0.01 3.13 0.00 -1.26 -1.43 121.76 122.34 2wvv s ALA 431 Ca -0.05 -0.75 -0.00 0.00 0.00 0.00 0.00 51.96 51.15 2wvv s ALA 431 Cb -0.00 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.86 2wvv s ALA 431 CO 0.05 0.28 0.02 0.99 0.00 0.00 0.00 175.76 177.10 2wvv s THR 432 N -0.58 -0.03 -0.10 0.00 2.01 -0.45 -1.24 115.64 115.25 2wvv s THR 432 Ca 0.04 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 61.85 2wvv s THR 432 Cb -0.07 -0.06 -0.02 0.00 0.01 0.00 0.00 72.50 72.36 2wvv s THR 432 CO 0.00 0.04 1.19 -0.22 -0.69 0.00 0.00 174.62 174.95 2wvv s LEU 433 N 0.53 4.24 0.21 4.42 2.96 -0.32 -0.43 118.68 130.28 2wvv s LEU 433 Ca -0.04 1.74 -0.10 0.00 -0.22 0.00 0.00 54.13 55.50 2wvv s LEU 433 Cb -0.06 -3.55 0.18 0.00 0.50 0.00 0.00 46.19 43.25 2wvv s LEU 433 CO -0.02 -0.62 1.85 0.25 -1.32 0.00 0.00 176.35 176.50 2wvv h LEU 434 N 8.61 0.74 -0.46 -0.68 5.85 -1.68 0.13 115.31 127.84 2wvv h LEU 434 Ca -0.31 -0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.23 2wvv h LEU 434 Cb 1.14 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.00 2wvv h LEU 434 CO 0.91 0.52 -0.54 0.71 -0.34 0.00 0.00 178.44 179.69 2wvv h THR 435 N 0.88 1.31 0.00 1.05 1.35 -1.87 -3.36 112.91 112.28 2wvv h THR 435 Ca 0.28 -1.77 -0.00 0.00 -0.55 0.00 0.00 66.41 64.36 2wvv h THR 435 Cb -0.01 1.72 -0.00 0.00 -1.73 0.00 0.00 68.15 68.13 2wvv h THR 435 CO -0.09 0.56 -1.58 0.35 -0.25 0.00 0.00 175.52 174.51 2wvv n THR 436 N -3.97 0.02 -1.00 6.82 -2.24 -1.14 -5.00 114.28 107.77 2wvv n THR 436 Ca -0.03 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2wvv n THR 436 Cb 0.61 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 2wvv n THR 436 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wvv n GLY 437 N 1.80 0.64 3.77 3.38 0.00 0.45 -5.02 105.19 110.21 2wvv n GLY 437 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2wvv n GLY 437 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvv s GLU 438 N -0.03 3.63 0.32 1.61 -1.05 -1.25 -4.67 118.70 117.25 2wvv s GLU 438 Ca 0.00 1.73 -0.28 0.00 -0.15 0.00 0.00 54.97 56.26 2wvv s GLU 438 Cb 0.00 -2.28 -0.10 0.00 -0.44 0.00 0.00 34.13 31.31 2wvv s GLU 438 CO 0.00 -0.65 1.16 0.34 0.95 0.00 0.00 175.26 177.06 2wvv s ASP 439 N -1.49 7.00 -0.12 0.83 2.15 -1.26 -1.18 116.67 122.60 2wvv s ASP 439 Ca 0.66 2.38 0.03 0.00 0.43 0.00 0.00 52.55 56.05 2wvv s ASP 439 Cb -0.27 -2.63 0.01 0.00 -0.30 0.00 0.00 42.92 39.73 2wvv s ASP 439 CO 0.32 -0.34 -0.23 -0.63 -0.17 0.00 0.00 175.17 174.12 2wvv s ILE 440 N -1.22 2.06 0.17 4.11 -1.09 -0.37 -4.87 121.20 119.99 2wvv s ILE 440 Ca 0.48 -1.00 -0.32 0.00 -2.23 0.00 0.00 60.65 57.59 2wvv s ILE 440 Cb -0.33 -1.80 -0.11 0.00 -1.58 0.00 0.00 42.46 38.64 2wvv s ILE 440 CO 0.43 0.55 1.65 -0.89 -1.23 0.00 0.00 174.94 175.46 2wvv s THR 441 N 0.61 2.40 -0.16 2.92 2.01 -1.26 -4.02 115.64 118.13 2wvv s THR 441 Ca -0.12 0.25 0.01 0.00 0.31 0.00 0.00 61.69 62.13 2wvv s THR 441 Cb -0.17 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 69.19 2wvv s THR 441 CO 0.03 0.02 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.11 2wvv s VAL 442 N 1.36 2.45 -0.17 3.82 1.01 -1.26 -1.25 120.40 126.36 2wvv s VAL 442 Ca 0.73 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.88 2wvv s VAL 442 Cb -0.46 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 33.90 2wvv s VAL 442 CO 0.32 0.52 -0.18 -0.69 0.00 0.00 0.00 175.10 175.07 2wvv s VAL 443 N 0.98 2.35 0.07 2.92 1.01 -0.15 -4.98 120.40 122.59 2wvv s VAL 443 Ca -0.02 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.79 2wvv s VAL 443 Cb -0.15 -1.98 -0.06 0.00 0.00 0.00 0.00 36.38 34.19 2wvv s VAL 443 CO -0.04 0.52 1.26 -0.70 0.00 0.00 0.00 175.10 176.14 2wvv s GLU 444 N 1.06 4.39 -0.12 2.72 2.12 -1.26 -0.16 118.70 127.44 2wvv s GLU 444 Ca -0.01 1.85 0.15 0.00 0.36 0.00 0.00 54.97 57.32 2wvv s GLU 444 Cb -0.14 -3.34 -0.21 0.00 0.26 0.00 0.00 34.13 30.69 2wvv s GLU 444 CO -0.06 -0.32 0.14 0.25 -0.54 0.00 0.00 175.26 174.73 2wvv n THR 445 N 3.99 0.81 -3.76 -1.70 -2.24 -0.28 -4.90 114.28 106.20 2wvv n THR 445 Ca 0.10 -0.60 -0.03 0.00 -2.27 0.00 0.00 64.05 61.24 2wvv n THR 445 Cb 0.45 -0.40 -0.01 0.00 -2.10 0.00 0.00 70.33 68.27 2wvv n THR 445 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2wvv s THR 446 N -2.59 0.00 0.19 4.28 -1.32 -1.17 -5.03 115.64 110.00 2wvv s THR 446 Ca -0.07 -0.63 -0.33 0.00 -1.21 0.00 0.00 61.69 59.45 2wvv s THR 446 Cb 0.06 -2.13 -0.14 0.00 -1.51 0.00 0.00 72.50 68.79 2wvv s THR 446 CO 0.67 0.00 1.52 -1.14 -2.21 0.00 0.00 174.62 173.46 2wvv n ARG 447 N -0.50 2.13 -1.07 7.08 0.00 -1.26 -1.17 116.66 121.86 2wvv n ARG 447 Ca -0.06 0.76 -0.02 0.00 -0.00 0.00 0.00 57.85 58.53 2wvv n ARG 447 Cb 0.61 -2.49 -0.01 0.00 0.00 0.00 0.00 32.46 30.56 2wvv n ARG 447 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2wvv n ASN 448 N 2.94 -4.72 -3.95 6.15 5.03 -1.26 -4.98 115.26 114.47 2wvv n ASN 448 Ca 0.15 0.06 -0.16 0.00 0.87 0.00 0.00 54.58 55.49 2wvv n ASN 448 Cb 0.30 -2.43 -0.15 0.00 -1.02 0.00 0.00 39.78 36.48 2wvv n ASN 448 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2wvv s GLU 449 N -1.55 0.48 0.03 3.52 2.12 -0.32 -0.65 118.70 122.35 2wvv s GLU 449 Ca 0.00 -0.18 0.01 0.00 0.36 0.00 0.00 54.97 55.16 2wvv s GLU 449 Cb 0.00 -0.48 -0.02 0.00 0.26 0.00 0.00 34.13 33.89 2wvv s GLU 449 CO 0.00 0.10 -0.06 0.71 -0.54 0.00 0.00 175.26 175.46 2wvv s TYR 450 N -0.00 0.52 -0.30 5.30 2.02 0.33 -1.13 117.35 124.09 2wvv s TYR 450 Ca 0.01 -0.51 -0.11 0.00 -0.37 0.00 0.00 57.07 56.09 2wvv s TYR 450 Cb -0.04 -0.32 -0.03 0.00 -0.40 0.00 0.00 41.96 41.17 2wvv s TYR 450 CO -0.00 -0.12 0.19 -0.80 -1.57 0.00 0.00 175.55 173.24 2wvv s ASN 451 N -1.52 5.83 -0.19 2.29 0.01 0.77 -0.69 114.94 121.44 2wvv s ASN 451 Ca -0.12 -0.29 -0.18 0.00 -0.71 0.00 0.00 52.86 51.56 2wvv s ASN 451 Cb -0.10 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.45 2wvv s ASN 451 CO -0.00 -0.15 0.49 -0.69 -1.51 0.00 0.00 177.10 175.24 2wvv s VAL 452 N 1.70 5.13 0.46 1.60 1.01 -0.12 -0.97 120.40 129.20 2wvv s VAL 452 Ca 0.06 0.90 -0.24 0.00 0.00 0.00 0.00 61.98 62.71 2wvv s VAL 452 Cb -0.17 -3.82 -0.07 0.00 0.00 0.00 0.00 36.38 32.33 2wvv s VAL 452 CO 0.09 0.21 1.24 -0.44 0.00 0.00 0.00 175.10 176.20 2wvv s SER 453 N 1.08 6.04 0.70 3.32 0.01 -0.38 0.32 113.70 124.79 2wvv s SER 453 Ca 0.23 2.49 -0.12 0.00 1.31 0.00 0.00 55.95 59.86 2wvv s SER 453 Cb -0.15 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.47 2wvv s SER 453 CO 0.09 -1.02 1.08 0.68 0.41 0.00 0.00 173.24 174.48 2wvv s VAL 454 N -1.41 3.67 0.60 3.43 -7.23 -0.91 -4.76 120.40 113.79 2wvv s VAL 454 Ca 0.63 0.61 -0.19 0.00 -1.81 0.00 0.00 61.98 61.21 2wvv s VAL 454 Cb -0.34 -3.20 -0.03 0.00 0.56 0.00 0.00 36.38 33.38 2wvv s VAL 454 CO 0.41 -0.64 1.30 -2.84 -0.31 0.00 0.00 175.10 173.02 2wvv s PRO 455 N -4.72 2.82 0.26 4.82 0.02 -1.26 -4.90 135.00 132.05 2wvv s PRO 455 Ca 0.61 2.07 -0.03 0.00 0.02 0.00 0.00 61.00 63.67 2wvv s PRO 455 Cb -0.16 -1.99 0.37 0.00 0.02 0.00 0.00 34.50 32.74 2wvv s PRO 455 CO 0.51 -1.39 1.90 -0.22 -0.33 0.00 0.00 177.00 177.46 2wvv h LYS 456 N 0.91 1.19 -5.16 5.54 3.64 -1.97 -3.37 116.57 117.35 2wvv h LYS 456 Ca -0.51 -0.07 -0.62 0.00 -1.27 0.00 0.00 60.65 58.18 2wvv h LYS 456 Cb 1.32 -0.27 -0.17 0.00 -0.41 0.00 0.00 32.23 32.70 2wvv h LYS 456 CO 0.55 0.79 -0.56 0.15 -2.27 0.00 0.00 179.45 178.10 2wvv s LYS 457 N -6.05 3.93 0.05 1.90 1.02 -1.26 -5.07 119.74 114.25 2wvv s LYS 457 Ca -0.13 -0.36 -0.30 0.00 0.02 0.00 0.00 55.97 55.21 2wvv s LYS 457 Cb 0.20 -3.32 -0.08 0.00 -0.52 0.00 0.00 37.83 34.10 2wvv s LYS 457 CO 0.82 0.12 1.81 1.21 -0.92 0.00 0.00 175.35 178.39 2wvv s ASN 458 N 0.81 6.51 0.60 2.83 3.84 -1.26 -4.88 114.94 123.39 2wvv s ASN 458 Ca 0.05 2.58 0.34 0.00 0.21 0.00 0.00 52.86 56.03 2wvv s ASN 458 Cb -0.13 -2.55 1.90 0.00 -0.55 0.00 0.00 41.25 39.92 2wvv s ASN 458 CO 0.02 -0.99 2.24 -0.65 -2.79 0.00 0.00 177.10 174.94 2wvv h PRO 459 N 9.48 0.00 -0.07 0.43 0.11 -1.97 -3.46 132.00 136.51 2wvv h PRO 459 Ca -0.45 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 2wvv h PRO 459 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2wvv h PRO 459 CO 0.94 0.03 -0.03 0.41 -0.21 0.00 0.00 178.00 179.14 2wvv n GLY 460 N -1.05 0.46 3.75 -0.55 0.00 -1.26 -4.96 105.19 101.58 2wvv n GLY 460 Ca -0.03 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 2wvv n GLY 460 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvv s GLU 461 N -1.09 1.67 0.28 1.61 -1.05 -1.26 -5.13 118.70 113.73 2wvv s GLU 461 Ca 0.00 -0.96 -0.30 0.00 -0.15 0.00 0.00 54.97 53.56 2wvv s GLU 461 Cb 0.00 0.58 -0.12 0.00 -0.44 0.00 0.00 34.13 34.15 2wvv s GLU 461 CO 0.00 -0.75 1.54 -2.30 0.95 0.00 0.00 175.26 174.70 2wvv n PRO 462 N -0.43 2.53 -4.24 -4.83 -0.02 -1.26 -4.97 135.00 121.77 2wvv n PRO 462 Ca -0.06 0.90 -0.15 0.00 -2.02 0.00 0.00 63.50 62.17 2wvv n PRO 462 Cb 0.60 -2.65 -0.09 0.00 -0.02 0.00 0.00 33.50 31.34 2wvv n PRO 462 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2wvv s TYR 463 N -0.08 1.40 -0.06 6.00 1.13 -0.91 -4.93 117.35 119.90 2wvv s TYR 463 Ca 0.64 -1.46 0.03 0.00 -1.41 0.00 0.00 57.07 54.88 2wvv s TYR 463 Cb -0.53 -0.65 0.01 0.00 -1.10 0.00 0.00 41.96 39.68 2wvv s TYR 463 CO 0.50 -0.68 -0.15 0.08 -2.51 0.00 0.00 175.55 172.78 2wvv s VAL 464 N -3.87 1.36 -0.18 -3.49 1.01 -1.26 -0.48 120.40 113.48 2wvv s VAL 464 Ca 0.39 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 2wvv s VAL 464 Cb 0.05 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 2wvv s VAL 464 CO 0.17 0.40 -0.04 -0.63 0.00 0.00 0.00 175.10 175.01 2wvv s ILE 465 N 0.39 3.74 -0.17 2.22 1.01 -0.06 -1.71 121.20 126.63 2wvv s ILE 465 Ca -0.11 -0.40 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 2wvv s ILE 465 Cb -0.14 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 2wvv s ILE 465 CO 0.04 0.47 0.37 -1.58 0.00 0.00 0.00 174.94 174.23 2wvv s GLN 466 N 0.73 4.25 -0.08 2.79 0.74 0.43 -0.41 119.66 128.11 2wvv s GLN 466 Ca -0.02 0.21 -0.04 0.00 0.05 0.00 0.00 55.36 55.57 2wvv s GLN 466 Cb -0.14 -3.47 -0.04 0.00 1.10 0.00 0.00 33.01 30.46 2wvv s GLN 466 CO 0.02 0.12 0.08 -0.51 -0.55 0.00 0.00 175.29 174.45 2wvv s LEU 467 N 0.80 4.00 -0.27 3.68 1.43 0.16 -1.35 118.68 127.13 2wvv s LEU 467 Ca 0.19 0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 53.45 2wvv s LEU 467 Cb -0.14 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2wvv s LEU 467 CO 0.07 0.36 0.27 -0.75 0.23 0.00 0.00 176.35 176.53 2wvv s LYS 468 N -1.17 4.00 0.32 1.70 2.20 -0.52 -2.63 119.74 123.64 2wvv s LYS 468 Ca 0.17 -0.15 0.09 0.00 -0.36 0.00 0.00 55.97 55.72 2wvv s LYS 468 Cb -0.12 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 2wvv s LYS 468 CO 0.06 -0.19 0.08 0.14 -0.36 0.00 0.00 175.35 175.08 2wvv s VAL 469 N 1.81 3.15 -0.04 4.02 -7.23 -1.26 -0.69 120.40 120.15 2wvv s VAL 469 Ca 0.11 -1.78 -0.09 0.00 -1.81 0.00 0.00 61.98 58.40 2wvv s VAL 469 Cb -0.16 -2.93 0.02 0.00 0.56 0.00 0.00 36.38 33.87 2wvv s VAL 469 CO 0.10 -0.25 0.22 -0.60 -0.31 0.00 0.00 175.10 174.26 2wvv s ARG 470 N -3.78 0.42 0.19 4.82 3.52 -0.46 -4.90 118.95 118.76 2wvv s ARG 470 Ca 0.35 -0.01 -0.33 0.00 -0.13 0.00 0.00 55.73 55.62 2wvv s ARG 470 Cb -0.04 0.19 -0.14 0.00 -1.56 0.00 0.00 34.95 33.40 2wvv s ARG 470 CO 0.21 -0.09 1.42 0.00 -0.81 0.00 0.00 175.30 176.04 2wvv n ALA 471 N 2.14 0.74 -1.48 6.12 0.00 -1.26 -0.64 120.51 126.13 2wvv n ALA 471 Ca -0.18 0.44 -0.32 0.00 0.00 0.00 0.00 53.44 53.38 2wvv n ALA 471 Cb 0.57 -2.25 0.05 0.00 0.00 0.00 0.00 19.45 17.83 2wvv n ALA 471 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvv s ALA 472 N 0.27 2.49 0.00 0.00 0.00 0.29 -4.78 121.76 120.03 2wvv s ALA 472 Ca 0.74 0.40 0.00 0.00 0.00 0.00 0.00 51.96 53.09 2wvv s ALA 472 Cb -0.71 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.13 2wvv s ALA 472 CO 0.46 -1.31 0.00 0.36 0.00 0.00 0.00 175.76 175.27 2wvv n LYS 473 N -2.71 0.00 -0.85 0.00 2.85 -1.26 -5.00 118.16 111.19 2wvv n LYS 473 Ca 0.09 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 57.02 2wvv n LYS 473 Cb 0.53 0.00 0.13 0.00 -0.65 0.00 0.00 35.03 35.03 2wvv n LYS 473 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 2wvv n LEU 478 N 0.00 1.03 -4.58 -5.58 7.94 -1.26 -5.24 117.00 109.32 2wvv n LEU 478 Ca 0.00 0.40 -0.24 0.00 -1.11 0.00 0.00 56.01 55.06 2wvv n LEU 478 Cb 0.00 -1.29 -0.09 0.00 0.53 0.00 0.00 43.42 42.57 2wvv n LEU 478 CO 0.00 -3.11 -0.39 -0.31 -1.11 0.00 0.00 177.39 172.47 2wvv s TYR 479 N -2.37 2.56 -0.05 1.96 2.02 -1.26 -5.05 117.35 115.17 2wvv s TYR 479 Ca 0.61 -0.26 0.03 0.00 -0.37 0.00 0.00 57.07 57.08 2wvv s TYR 479 Cb -0.24 -1.16 0.01 0.00 -0.40 0.00 0.00 41.96 40.17 2wvv s TYR 479 CO 0.63 0.62 -0.12 1.03 -1.57 0.00 0.00 175.55 176.14 2wvv s ARG 480 N -3.42 1.40 0.68 -0.62 0.52 -1.26 -5.14 118.95 111.11 2wvv s ARG 480 Ca 0.29 -0.39 -0.15 0.00 -0.52 0.00 0.00 55.73 54.96 2wvv s ARG 480 Cb -0.07 -1.22 0.01 0.00 0.52 0.00 0.00 34.95 34.19 2wvv s ARG 480 CO 0.17 0.09 1.13 -0.51 0.02 0.00 0.00 175.30 176.21 2wvv s ASP 481 N 0.39 4.84 0.00 0.23 1.11 -1.26 -4.98 116.67 117.00 2wvv s ASP 481 Ca -0.08 2.09 -0.30 0.00 0.18 0.00 0.00 52.55 54.44 2wvv s ASP 481 Cb -0.12 -2.56 -0.05 0.00 1.07 0.00 0.00 42.92 41.26 2wvv s ASP 481 CO 0.02 -1.82 1.27 0.00 1.18 0.00 0.00 175.17 175.82 2wvv s ALA 482 N -2.25 3.49 -0.37 5.23 0.00 -1.26 -4.99 121.76 121.62 2wvv s ALA 482 Ca 0.69 0.78 -0.24 0.00 0.00 0.00 0.00 51.96 53.19 2wvv s ALA 482 Cb -0.23 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.39 2wvv s ALA 482 CO 0.43 -0.70 0.84 -1.17 0.00 0.00 0.00 175.76 175.15 2wvv s LEU 483 N 1.88 4.08 0.00 0.00 2.96 -1.26 -5.08 118.68 121.25 2wvv s LEU 483 Ca 0.59 0.44 0.00 0.00 -0.22 0.00 0.00 54.13 54.94 2wvv s LEU 483 Cb -0.29 -3.12 0.00 0.00 0.50 0.00 0.00 46.19 43.29 2wvv s LEU 483 CO 0.26 -0.78 0.32 0.35 -1.32 0.00 0.00 176.35 175.17